Search results

Formula: - Ag0.35 S2 Ti -
Comments: Zondag, J.E.; Wiegers, G.A.; van Smaalen, S.; Haange, R.J.; Bronsema, K.D.; de Boer, J.L. X-ray study of the second-order phase transition of Ag0.35 Ti S2: A phase transition characterized by two order parameters Journal of Solid State Chemistry 67 (1987) 9-20
Space group: P -3 1 c
Cell volume: 387.945
Cell parameters: 5.9288; 5.9288; 12.744; 90; 90; 120;

COD ID: 1509347
CIF file	Formula: - Ag Ga P2 Se6 - Comments: Kniep, R.; Pfeiff, R. Quaternary selenodiphosphates(IV):M(I)M(III)(P2Se6), (M(I)=Cu,Ag;M(III)=Cr,Al,Ga,In) Journal of Alloys Compd. 186 (1992) 111-133 Space group: P -3 1 c Cell volume: 468.808 Cell parameters: 6.375; 6.375; 13.32; 90; 90; 120;

COD ID: 1509399
CIF file	Formula: - Ag In P2 Se6 - Comments: Kniep, R.; Pfeiff, R. Quaternary selenodiphosphates(IV):M(I)M(III)(P2Se6), (M(I)=Cu,Ag;M(III)=Cr,Al,Ga,In) Journal of Alloys Compd. 186 (1992) 111-133 Space group: P -3 1 c Cell volume: 485.191 Cell parameters: 6.483; 6.483; 13.33; 90; 90; 120;

COD ID: 1514395
CIF file	Formula: - C51 H33 N7 O20 Zn3 - Comments: Park, Hye Jeong; Suh, Myunghyun Paik Enhanced isosteric heat, selectivity, and uptake capacity of CO2 adsorption in a metal-organic framework by impregnated metal ions Chemical Science 4(2) (2013) 685 Space group: P -3 1 c Cell volume: 3308.6 Cell parameters: 16.49; 16.49; 14.05; 90; 90; 120;

COD ID: 1516509

Formula: - C6 Fe K La N6 -
Comments: Duyker, S. G.; Halder, G. J.; Southon, P. D.; Price, D. J.; Edwards, A. J.; Peterson, V. K.; Kepert, C. J. Topotactic structural conversion and hydration-dependent thermal expansion in robust LnMIII(CN)6·nH2O and flexible ALnFeII(CN)6·nH2O frameworks (A = Li, Na, K; Ln = La‒Lu, Y; M = Co, Fe; 0 ≤ n ≤ 5) Chemical Science 5(9) (2014) 3409
Space group: P -3 1 c
Cell volume: 547.2
Cell parameters: 7.1852; 7.1852; 12.238; 90; 90; 120;

COD ID: 1516857
CIF file	Formula: - C30 H24 Cl2 N12 Zn - Comments: Feng Guo Hydrothermal syntheses, crystal structure and luminescent properties of four zinc(II) coordination polymers based on tipodal imidazole Inorganica Chimica Acta 399 (2013) 79-84 Space group: P -3 1 c Cell volume: 1734.4 Cell parameters: 11.472; 11.472; 15.217; 90; 90; 120;

COD ID: 1520988
CIF file	Formula: - Cl18 Cs Pb Ta6 - Comments: Cordier, S.; Loisel, C.; Sergent, M.; Perrin, C. Tantalum chlorides in octahedral cluster chemistry: the structures of Cs2 Pb Ta6 Cl18 and Cs Pb Ta6 Cl18 Journal of Solid State Chemistry 147 (1999) 350-357 Space group: P -3 1 c Cell volume: 1282.92 Cell parameters: 9.2673; 9.2673; 17.249; 90; 90; 120;

COD ID: 1522183

Formula: - Al24 O96 P24 -
Comments: Wilson, S.T.; Broach, R.W.; Bateman, C.A.; Blackwell, C.S.; McGuire, N.K.; Kirchner, R.M. Synthesis, characterization and structure of SAPO-56, a member of the ABC double-six-ring family of materials with stacking sequence AABBCCBB Microporous and Mesoporous Materials 28 (1999) 125-137
Space group: P -3 1 c
Cell volume: 3267.58
Cell parameters: 13.7571; 13.7571; 19.93619; 90; 90; 120;

COD ID: 1522213

Formula: - Na1.84 O6 Sn Te -
Comments: Woodward, P.M.; Sleight, A.W.; Du, L.-S.; Grey, C.P. Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6 Journal of Solid State Chemistry 147 (1999) 99-116
Space group: P -3 1 c
Cell volume: 264.375
Cell parameters: 5.3416; 5.3416; 10.6991; 90; 90; 120;

COD ID: 1522215

Formula: - Ge Na2 O6 Te -
Comments: Woodward, P.M.; Grey, C.P.; Sleight, A.W.; Du, L.-S. Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6 Journal of Solid State Chemistry 147 (1999) 99-116
Space group: P -3 1 c
Cell volume: 239.106
Cell parameters: 5.0958; 5.0958; 10.6325; 90; 90; 120;

COD ID: 1523249
CIF file	Formula: - Pt3 Tl2 - Comments: Bhan, S.; Goedecke, T.; Panday, P.K.; Schubert, K. Ueber die Mischungen Pd-Tl und Pt-Tl Journal of the Less-Common Metals 16 (1968) 415-425 Space group: P -3 1 c Cell volume: 382.243 Cell parameters: 5.645; 5.645; 13.851; 90; 90; 120;

COD ID: 1526941
CIF file	Formula: - C6 Mg N6 Na4 S6 - Comments: Wickleder, C.; Larsen, P. Ba Cl S C N und Na4 Mg (S C N)6: zwei neue wasserfreie Thiocyanate der Erdalkalimetalle Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 1279-1282 Space group: P -3 1 c Cell volume: 904.207 Cell parameters: 8.638; 8.638; 13.993; 90; 90; 120;

COD ID: 1527084
CIF file	Formula: - Cr2 Te3 - Comments: Andresen, A.F. The magnetic structure of Cr2 Te3, Cr3 Te4, and Cr5 Te6 Acta Chemica Scandinavica (1-27,1973-42,1988) 24 (1970) 3495-3509 Space group: P -3 1 c Cell volume: 485.456 Cell parameters: 6.814; 6.814; 12.073; 90; 90; 120;

COD ID: 1527711

Formula: - Ce1.2 Ga9.8 Pt4 -
Comments: Lacerda, A.; Canfield, P.C.; Goldstone, J.; Hundley, M.F.; Beyermann, W.P.; Sparn, G.; Barnhart, D.; Thompson, J.P.; Fisk, Z.; Burns, C.; Lawson, A.C.; Kwei, G.H. Possible heavy-fermion behavior and field-induced transitions in new R-Pt-Ga compounds Journal of Alloys Compd. 181 (1992) 191-196
Space group: P -3 1 c
Cell volume: 266.069
Cell parameters: 4.313; 4.313; 16.516; 90; 90; 120;

COD ID: 1528136
CIF file	Formula: - Ga22.13 Li11.33 Zn2.66 - Comments: Tillard-Charbonnel, M.; Chahin, A.; Belin, C. A new intermetallic phase in the ternary system: Li-Zn-Ga, a hexagonal-type arrangement of extended icosahedral units Materials Research Bulletin 28 (1993) 1285-1294 Space group: P -3 1 c Cell volume: 3785.35 Cell parameters: 13.657; 13.657; 23.435; 90; 90; 120;

COD ID: 1528761

Formula: - C18 H54 N3 Si6 Yb -
Comments: Niemeyer, M. Synthesis and structural characterization of several ytterbium bis(trimethylsilyl)amides including base-free [Yb {N (Si Me3)2}2 (mue-Cl)]2 - a coordinatively unsaturated complex with additional agostic Yb...(H3 C-Si) interactions Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 647-657
Space group: P -3 1 c
Cell volume: 1979.54
Cell parameters: 16.364; 16.364; 8.536; 90; 90; 120;

COD ID: 1529954
CIF file	Formula: - O Ti3 - Comments: Fykin, L.E.; Vavilova, V.V.; Kornilov, I.I.; Solov'ev, S.P.; Ozerov, R.P. Neutrondiffraction investigation of phases in system titanium oxygen Doklady Akademii Nauk SSSR 191 (1970) 96-99 Space group: P -3 1 c Cell volume: 219.585 Cell parameters: 5.15; 5.15; 9.56; 90; 90; 120;

COD ID: 1529955
CIF file	Formula: - O Ti6 - Comments: Fykin, L.E.; Solov'ev, S.P.; Kornilov, I.I.; Ozerov, R.P.; Vavilova, V.V. Neutrondiffraction investigation of phases in system titanium oxygen Doklady Akademii Nauk SSSR 191 (1970) 96-99 Space group: P -3 1 c Cell volume: 216.06 Cell parameters: 5.13; 5.13; 9.48; 90; 90; 120;

COD ID: 1533202
CIF file	Formula: - Cu0.98 La O2.58 - Comments: Garlea, O.; Darie, C.; Isnard, O.; Bordet, P.; Bougerol, C. Structure of La Cu O2.66: an oxidized delafossite compound containing hole-doped kagome planes of Cu(2+) cations Solid State Sciences 5 (2003) 1095-1104 Space group: P -3 1 c Cell volume: 404.207 Cell parameters: 6.6941; 6.6941; 10.4157; 90; 90; 120;

COD ID: 1533203
CIF file	Formula: - Cu0.93 La O2.57 - Comments: Garlea, O.; Bougerol, C.; Darie, C.; Isnard, O.; Bordet, P. Structure of La Cu O2.66: an oxidized delafossite compound containing hole-doped kagome planes of Cu(2+) cations Solid State Sciences 5 (2003) 1095-1104 Space group: P -3 1 c Cell volume: 403.647 Cell parameters: 6.69461; 6.69461; 10.3997; 90; 90; 120;

COD ID: 1533204
CIF file	Formula: - Cu0.98 La O2.59 - Comments: Garlea, O.; Darie, C.; Bordet, P.; Bougerol, C.; Isnard, O. Structure of La Cu O2.66: an oxidized delafossite compound containing hole-doped kagome planes of Cu(2+) cations Solid State Sciences 5 (2003) 1095-1104 Space group: P -3 1 c Cell volume: 402.155 Cell parameters: 6.68821; 6.68821; 10.3811; 90; 90; 120;

COD ID: 1534385
CIF file	Formula: - Ni0.33 S2 Ti - Comments: Danot, M.; Bichon, J.; Rouxel, J. Le systeme nickel-disulfure de titane Bulletin de la Societe Chimique de France (Vol=Year) 1972 (1972) 3063-3066 Space group: P -3 1 c Cell volume: 338.947 Cell parameters: 5.88; 5.88; 11.32; 90; 90; 120;

COD ID: 1534551
CIF file	Formula: - Cl4 Mo - Comments: Schaefer, H.; Baumann, H.; Tillack, J.V.; von Schnering, H.G.; Woehrle, H.; Kuhnen, F. Neue Untersuchungen ueber die Chloride das Molybdaens Zeitschrift fuer Anorganische und Allgemeine Chemie 353 (1967) 281-310 Space group: P -3 1 c Cell volume: 371.03 Cell parameters: 6.058; 6.058; 11.674; 90; 90; 120;

COD ID: 1535387
CIF file	Formula: - Br6 Na3 Sc - Comments: Bohnsack, A.; Meyer, G. Ternaere Halogenide des Scandiums mit Natrium, Na3 Sc X6 (X= F, Cl, Br): Synthese, Strukturen, Ionenleitfaehigkeit Zeitschrift fuer Anorganische und Allgemeine Chemie 622 (1996) 173-178 Space group: P -3 1 c Cell volume: 595.617 Cell parameters: 7.251; 7.251; 13.081; 90; 90; 120;

COD ID: 1535650
CIF file	Formula: - Cl3 Ti - Comments: Troyanov, S.I.; Snigireva, E.M.; Rybakov, V.B. X-ray diffraction study of phase transition in alpha-TiCl3 Zhurnal Neorganicheskoi Khimii 36 (1991) 1117-1122 Space group: P -3 1 c Cell volume: 382.953 Cell parameters: 6.143; 6.143; 11.718; 90; 90; 120;

COD ID: 1535673
CIF file	Formula: - Cl6 Fe Zr - Comments: Troyanov, S.I.; Kharisov, B.I.; Berdonosov, S.S. Crystal structure of Fe Zr Cl6 - a new structural type for ABX6 compounds. Zhurnal Neorganicheskoi Khimii 37 (1992) 2424-2429 Space group: P -3 1 c Cell volume: 403.128 Cell parameters: 6.284; 6.284; 11.788; 90; 90; 120;

COD ID: 1535690
CIF file	Formula: - Cl6 Fe Hf - Comments: Troyanov, S.I.; Kharisov, B.I.; Berdonosov, S.S. X-ray structural study of iron(II) hexachlorohafnate(IV) FeHfCl6 Zhurnal Neorganicheskoi Khimii 38 (1993) 476-477 Space group: P -3 1 c Cell volume: 401.539 Cell parameters: 6.274; 6.274; 11.779; 90; 90; 120;

COD ID: 1536653

Formula: - Cs2 I14 Mo6 -
Comments: Kirakci, K.; Perrin, C.; Cordier, S. Synthesis and characterization of Cs2 Mo6 X14 (X = Br or I) hexamolybdenum cluster halides: efficient Mo6 cluster precursors for solution chemistry synthesis Zeitschrift fuer Anorganische und Allgemeine Chemie 631 (2005) 411-416
Space group: P -3 1 c
Cell volume: 1643.49
Cell parameters: 10.804; 10.804; 16.258; 90; 90; 120;

COD ID: 1536656

Formula: - Br14 Cs2 Mo6 -
Comments: Kirakci, K.; Cordier, S.; Perrin, C. Synthesis and characterization of Cs2 Mo6 X14 (X = Br or I) hexamolybdenum cluster halides: efficient Mo6 cluster precursors for solution chemistry synthesis Zeitschrift fuer Anorganische und Allgemeine Chemie 631 (2005) 411-416
Space group: P -3 1 c
Cell volume: 1355.74
Cell parameters: 10.1925; 10.1925; 15.069; 90; 90; 120;

COD ID: 1537056
CIF file	Formula: - Br14 Cs2 W6 - Comments: Zheng, Y.-Q.; Peters, K.; Grin', Yu.; von Schnering, H.G. Syntheses and crystal structures of the cluster compounds A2 ((W6 Br8) Br6) with A =K, Rb, Cs Zeitschrift fuer Anorganische und Allgemeine Chemie 624 (1998) 506-512 Space group: P -3 1 c Cell volume: 1357.44 Cell parameters: 10.18; 10.18; 15.125; 90; 90; 120;

COD ID: 1539773
CIF file	Formula: - Mo Ni P8 - Comments: Dewalsky, M.V.; Jeitschko, W. Preparation, physical properties and crystal structure of Mo Ni P8 and W Ni P8 Acta Chemica Scandinavica (43,1989-) 45 (1991) 828-832 Space group: P -3 1 c Cell volume: 292.688 Cell parameters: 6.222; 6.222; 8.73; 90; 90; 120;

COD ID: 1539839
CIF file	Formula: - Cl15 Cs2 Nb6 O3 U - Comments: Cordier, S.; Sergent, M.; Perrin, C. New series of niobium oxychlorides, M2 RE Nb6 Cl15 O3 (M= monovalent cation, RE= rare earth) and M2 U Nb6 Cl15 O3. The crystal structure of Cs2 U Nb6 Cl15 O3 Materials Research Bulletin 32 (1997) 25-33 Space group: P -3 1 c Cell volume: 1255.25 Cell parameters: 9.208; 9.208; 17.095; 90; 90; 120;

COD ID: 1546836
CIF file	Formula: - C0 H18 B69 Mg7 N0 O126 - Comments: Wang, Jia-Jia; Yang, Guo-Yu A novel supramolecular magnesoborate framework with snowflake-like channels built by unprecedented huge B <sub>69</sub> cluster cages Chemical Communications 53(75) (2017) 10398-10401 Space group: P -3 1 c Cell volume: 9126.81 Cell parameters: 26.1715; 26.1715; 15.3862; 90; 90; 120;

COD ID: 1550737

Formula: - Bi3 Cl16 Rb7 -
Comments: Xie, Jie-Ling; Huang, Zhao-Qian; Wang, Bin; Chen, Wei-Jun; Lu, Wen-Xiu; Liu, Xin; Song, Jun-Ling New lead-free perovskite Rb7Bi3Cl16 nanocrystals with blue luminescence and excellent moisture-stability. Nanoscale 11(14) (2019) 6719-6726
Space group: P -3 1 c
Cell volume: 1695.99
Cell parameters: 7.5561; 7.5561; 34.3002; 90; 90; 120;

COD ID: 1551166

Formula: - C33 H24 O12 -
Comments: Zhou, Yue; Kan, Liang; Eubank, Jarrod F.; Li, Guanghua; Zhang, Lirong; Liu, Yunling Self-assembly of two robust 3D supramolecular organic frameworks from a geometrically non-planar molecule for high gas selectivity performance Chemical Science (2019)
Space group: P -3 1 c
Cell volume: 4390.2
Cell parameters: 12.2358; 12.2358; 33.86; 90; 90; 120;

COD ID: 1551507

Formula: - C8 H24 N6 O4 Zn -
Comments: Zi-Shuo Yao; Masaki Mito; Takashi Kamachi; Yoshihito Shiota; Kazunari Yoshizawa; Nobuaki Azuma; Yuji Miyazaki; Kazuyuki Takahashi; Kuirun Zhang; Takumi Nakanishi; Soonchul Kang; Shinji Kanegawa; Osamu Sato Molecular motor-driven abrupt anisotropic shape change in a single crystal of a Ni complex Nature Chemistry 6 (2014) 1079-1083
Space group: P -3 1 c
Cell volume: 724.4
Cell parameters: 8.9542; 8.9542; 10.433; 90; 90; 120;

COD ID: 1551509

Formula: - C8 H24 N6 Ni O4 -
Comments: Zi-Shuo Yao; Masaki Mito; Takashi Kamachi; Yoshihito Shiota; Kazunari Yoshizawa; Nobuaki Azuma; Yuji Miyazaki; Kazuyuki Takahashi; Kuirun Zhang; Takumi Nakanishi; Soonchul Kang; Shinji Kanegawa; Osamu Sato Molecular motor-driven abrupt anisotropic shape change in a single crystal of a Ni complex Nature Chemistry 6 (2014) 1079-1083
Space group: P -3 1 c
Cell volume: 713.8
Cell parameters: 8.866; 8.866; 10.486; 90; 90; 120;

COD ID: 1551511

Formula: - C8 H24 N6 Ni O4 -
Comments: Zi-Shuo Yao; Masaki Mito; Takashi Kamachi; Yoshihito Shiota; Kazunari Yoshizawa; Nobuaki Azuma; Yuji Miyazaki; Kazuyuki Takahashi; Kuirun Zhang; Takumi Nakanishi; Soonchul Kang; Shinji Kanegawa; Osamu Sato Molecular motor-driven abrupt anisotropic shape change in a single crystal of a Ni complex Nature Chemistry 6 (2014) 1079-1083
Space group: P -3 1 c
Cell volume: 715.4
Cell parameters: 8.875; 8.875; 10.488; 90; 90; 120;

COD ID: 1551513

Formula: - C8 H12 D12 N6 Ni O4 -
Comments: Zi-Shuo Yao; Masaki Mito; Takashi Kamachi; Yoshihito Shiota; Kazunari Yoshizawa; Nobuaki Azuma; Yuji Miyazaki; Kazuyuki Takahashi; Kuirun Zhang; Takumi Nakanishi; Soonchul Kang; Shinji Kanegawa; Osamu Sato Molecular motor-driven abrupt anisotropic shape change in a single crystal of a Ni complex Nature Chemistry 6 (2014) 1079-1083
Space group: P -3 1 c
Cell volume: 717.6
Cell parameters: 8.882; 8.882; 10.504; 90; 90; 120;

COD ID: 1553986

Formula: - C150 H132 Au13 Cl5 P12 -
Comments: Zhang, Shan-Shan; Feng, Lei; Senanayake, Ravithree D.; Aikens, Christine M.; Wang, Xing-Po; Zhao, Quan-Qin; Tung, Chen-Ho; Sun, Di Diphosphine-protected ultrasmall gold nanoclusters: opened icosahedral Au13 and heart-shaped Au8 clusters. Chemical science 9(5) (2018) 1251-1258
Space group: P -3 1 c
Cell volume: 9362.8
Cell parameters: 19.878; 19.878; 27.361; 90; 90; 120;

COD ID: 1559217

Formula: - C I3 Pb -
Comments: Yang, Ning; Zhu, Cheng; Chen, Yihua; Zai, Huachao; Wang, Chenyue; Wang, Xi; Wang, Hao; Ma, Sai; Gao, Ziyan; Wang, Xueyun; Hong, Jiawang; Bai, Yang; Zhou, Huanping; Cui, Bin-Bin; Chen, Qi An in situ cross-linked 1D/3D perovskite heterostructure improves the stability of hybrid perovskite solar cells for over 3000 h operation Energy & Environmental Science 13(11) (2020) 4344-4352
Space group: P -3 1 c
Cell volume: 547.13
Cell parameters: 8.7795; 8.7795; 8.1964; 90; 90; 120;

COD ID: 1561143

Formula: - C8 H14 Cr Mn N O13 -
Comments: Mączka, Mirosław; Janczak, Jan; Hermanowicz, Krzysztof; Pikul, Adam; Hanuza, Jerzy Magnetic, optical and phonon properties of novel heterometallic formates [NH3CH2CH2OH][MIIIMII(HCOO)6] (MIII = Fe, Cr; MII = Mn, Ni, Co) Journal of Solid State Chemistry 260 (2018) 7-15
Space group: P -3 1 c
Cell volume: 832.13
Cell parameters: 8.2675; 8.2675; 14.0576; 90; 90; 120;

COD ID: 1561144

Formula: - C8 H14 Cr Mn N O13 -
Comments: Mączka, Mirosław; Janczak, Jan; Hermanowicz, Krzysztof; Pikul, Adam; Hanuza, Jerzy Magnetic, optical and phonon properties of novel heterometallic formates [NH3CH2CH2OH][MIIIMII(HCOO)6] (MIII = Fe, Cr; MII = Mn, Ni, Co) Journal of Solid State Chemistry 260 (2018) 7-15
Space group: P -3 1 c
Cell volume: 839.52
Cell parameters: 8.2876; 8.2876; 14.1138; 90; 90; 120;

COD ID: 1561145

Formula: - C28 H17 Cu2 N O10 -
Comments: Duan, Xing; Zhou, You; Lv, Ran; Yu, Ben; Chen, Haodong; Ji, Zhenguo; Cui, Yuanjing; Yang, Yu; Qian, Guodong A new metal-organic framework for separation of C2H2/CH4 and CO2/CH4 at room temperature Journal of Solid State Chemistry 260 (2018) 31-33
Space group: P -3 1 c
Cell volume: 10402
Cell parameters: 18.7309; 18.7309; 34.235; 90; 90; 120;

COD ID: 1561230
CIF file	Formula: - C9 H16 Fe2 N O12 - Comments: Mączka, Mirosław; Kucharska, Edyta; Gągor, Anna; Pikul, Adam; Hanuza, Jerzy Synthesis, magnetic and vibrational properties of two novel mixed-valence iron(II)-iron(III) formate frameworks Journal of Solid State Chemistry 258 (2018) 163-169 Space group: P -3 1 c Cell volume: 827.55 Cell parameters: 8.3389; 8.3389; 13.7419; 90; 90; 120;

COD ID: 1561231
CIF file	Formula: - C8 H14 Fe2 N O13 - Comments: Mączka, Mirosław; Kucharska, Edyta; Gągor, Anna; Pikul, Adam; Hanuza, Jerzy Synthesis, magnetic and vibrational properties of two novel mixed-valence iron(II)-iron(III) formate frameworks Journal of Solid State Chemistry 258 (2018) 163-169 Space group: P -3 1 c Cell volume: 833.28 Cell parameters: 8.2317; 8.2317; 14.1998; 90; 90; 120;

COD ID: 1562609
CIF file	Formula: - C B15 Ba Li9 O30 - Comments: Heyward, Carla; McMillen, Colin D.; Kolis, Joseph Hydrothermal synthesis and structural analysis of new mixed oxyanion borates: Ba11B26O44(PO4)2(OH)6, Li9BaB15O27(CO3) and Ba3Si2B6O16 Journal of Solid State Chemistry 203 (2013) 166-173 Space group: P -3 1 c Cell volume: 1029.8 Cell parameters: 8.8599; 8.8599; 15.148; 90; 90; 120;

COD ID: 1563049
CIF file	Formula: - Cu3 Er S3 - Comments: Gulay, L.D.; Daszkiewicz, M.; Shemet, V.Ya. Crystal structure of ∼RCu3S3 and ∼RCuTe2 (R=Gd‒Lu) compounds Journal of Solid State Chemistry 186 (2012) 142-148 Space group: P -3 1 c Cell volume: 493.78 Cell parameters: 6.707; 6.707; 12.675; 90; 90; 120;

COD ID: 1563726
CIF file	Formula: - Co2 H11 N2 O9 P3 - Comments: Cheng, Chi-Chang; Chang, Wei-Kuo; Chiang, Ray-Kuang; Wang, Sue-Lein Synthesis and structural characterization of two cobalt phosphites: 1-D (H3NC6H4NH3)Co(HPO3)2 and 2-D (NH4)2Co2(HPo3)3 Journal of Solid State Chemistry 183(2) (2010) 304-309 Space group: P -3 1 c Cell volume: 467.75 Cell parameters: 5.3671; 5.3671; 18.75; 90; 90; 120;

COD ID: 1568465
CIF file	Formula: - C105 Br19 Mn2 N6 Pb3 - Comments: Zhang, Zhipeng; Liao, Jin-Feng; Xing, Guichuan Regulating the coordination geometry of polyhedra in zero-dimensional metal halides for tunable emission. Nanoscale 15(11) (2023) 5241-5248 Space group: P -3 1 c Cell volume: 6393.7 Cell parameters: 15.233; 15.233; 31.8165; 90; 90; 120;

COD ID: 1568466
CIF file	Formula: - C60 Br19 N6 Pb3 Zn2 - Comments: Zhang, Zhipeng; Liao, Jin-Feng; Xing, Guichuan Regulating the coordination geometry of polyhedra in zero-dimensional metal halides for tunable emission. Nanoscale 15(11) (2023) 5241-5248 Space group: P -3 1 c Cell volume: 6334.78 Cell parameters: 15.1977; 15.1977; 31.6698; 90; 90; 120;

COD ID: 2009901
CIF file Original IUCr paper	Formula: - C36 H32 F12 O P6 W - Comments: Crump, W.; Kruck, Th.; Siegers, B.; Tebbe, K.-F. Hexakis(difluorphenylphosphan)wolfram(0) hydrat, W(PF~2~Ph)~6~.H~2~O Acta Crystallographica Section C 50(7) (1994) 1074-1076 Space group: P -3 1 c Cell volume: 2234.7 Cell parameters: 13.258; 13.258; 14.68; 90; 90; 120;

COD ID: 2017493

Formula: - B2 Cd F K O6 Zn2 -
Comments: Zhang, Fan; Jiao, Zhi-Wei; Shen, De-Zhong; Shen, Guang-Qiu; Wang, Xiao-Qing CdZn~2~KB~2~O~6~F, a new fluoride borate crystal Acta Crystallographica Section C 66(1) (2010) i1-i3
Space group: P -3 1 c
Cell volume: 333.13
Cell parameters: 5.0381; 5.0381; 15.155; 90; 90; 120;

COD ID: 2020261
CIF file	Formula: - Cl18 Cs Lu Nb6 - Comments: Ihmaine, S.; Perrin, C.; Sergent, M. Structure of a new quaternary niobium chloride with Nb6 clusters: Cs Lu Nb6 Cl18 Acta Crystallographica C (39,1983-) 45 (1989) 705-707 Space group: P -3 1 c Cell volume: 1255.2 Cell parameters: 9.1882; 9.1882; 17.1681; 90; 90; 120;

COD ID: 2022908

Formula: - Cl15 Cs2 Gd Nb6 O3 -
Comments: Silaban, Saronom; Haryani, Maefa Eka; Gulo, Fakhili; Perrin, Christiane Crystal structure of Cs2GdNb6Cl15O3 in the structural evolution of niobium oxychlorides with octa-hedral Nb6-cluster units. Acta crystallographica. Section E, Crystallographic communications 79(Pt 11) (2023) 1008-1011
Space group: P -3 1 c
Cell volume: 1238.95
Cell parameters: 9.1318; 9.1318; 17.1558; 90; 90; 120;

COD ID: 2102217
CIF file Original IUCr paper	Formula: ? Comments: Simon Allen; Rebecca Ward; Matthew Hampson; Richard K B Gover; John S O Evans Structures and phase transitions of trigonal ZrMo~2~O~8~ and HfMo~2~O~8~ Acta Crystallographica Section B 60(1) (2004) 32-40 Space group: P -3 1 c Cell volume: 1041.59 Cell parameters: 10.1367; 10.1367; 11.705; 90; 90; 120;

COD ID: 2102218
CIF file Original IUCr paper	Formula: ? Comments: Simon Allen; Rebecca Ward; Matthew Hampson; Richard K B Gover; John S O Evans Structures and phase transitions of trigonal ZrMo~2~O~8~ and HfMo~2~O~8~ Acta Crystallographica Section B 60(1) (2004) 32-40 Space group: P -3 1 c Cell volume: 1037.33 Cell parameters: 10.1043; 10.1043; 11.732; 90; 90; 120;

COD ID: 2102423
CIF file Original IUCr paper	Formula: - C18 H42 Cl2 Mn N8 O8 - Comments: Marsh, Richard E. Space group <i>Cc</i>: an update Acta Crystallographica Section B 60(2) (2004) 252-253 Space group: P -3 1 c Cell volume: 1358.29 Cell parameters: 9.597; 9.597; 17.029; 90; 90; 120;

COD ID: 2103577
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1042.53 Cell parameters: 10.13792; 10.13792; 11.71279; 90; 90; 120;

COD ID: 2103578
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1041.46 Cell parameters: 10.14778; 10.14778; 11.678; 90; 90; 120;

COD ID: 2103579
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1033.37 Cell parameters: 10.13896; 10.13896; 11.60753; 90; 90; 120;

COD ID: 2103580
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1027.44 Cell parameters: 10.14226; 10.14226; 11.5334; 90; 90; 120;

COD ID: 2103581
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1020.46 Cell parameters: 10.13168; 10.13168; 11.479; 90; 90; 120;

COD ID: 2103582
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1018.12 Cell parameters: 10.1375; 10.1375; 11.4395; 90; 90; 120;

COD ID: 2103583
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1012.38 Cell parameters: 10.13183; 10.13183; 11.3877; 90; 90; 120;

COD ID: 2103584
CIF file Original IUCr paper	Formula: - Mo2 O8 Zr - Comments: Krogh Andersen, Anne Marie; Carlson, Stefan High-pressure structures of α- and δ-ZrMo~2~O~8~ Acta Crystallographica Section B 57(1) (2001) 20-26 Space group: P -3 1 c Cell volume: 1005.74 Cell parameters: 10.1264; 10.1264; 11.3252; 90; 90; 120;

COD ID: 2104880

Formula: - C6 H24 N6 O4 S Zn -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 664.46
Cell parameters: 8.9594; 8.9594; 9.5583; 90; 90; 120;

COD ID: 2104881

Formula: - C6 H24 N6 O4 S Zn -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 665.986
Cell parameters: 8.9649; 8.9649; 9.5685; 90; 90; 120;

COD ID: 2104882

Formula: - C6 H24 N6 O4 S Zn -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 667.78
Cell parameters: 8.9696; 8.9696; 9.5842; 90; 90; 120;

COD ID: 2104883

Formula: - C6 H24 N6 O4 S Zn -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 670.094
Cell parameters: 8.979; 8.979; 9.5973; 90; 90; 120;

COD ID: 2104884

Formula: - C6 H24 N6 O4 S Zn -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 671.55
Cell parameters: 8.9855; 8.9855; 9.6043; 90; 90; 120;

COD ID: 2104885

Formula: - C6 H24 N6 O4 S Zn -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 673.07
Cell parameters: 8.9929; 8.9929; 9.6101; 90; 90; 120;

COD ID: 2104886

Formula: - C6 H24 Cu N6 O4 S -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 662.66
Cell parameters: 8.9387; 8.9387; 9.5766; 90; 90; 120;

COD ID: 2104887

Formula: - C6 H24 Cu N6 O4 S -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 663.936
Cell parameters: 8.9445; 8.9445; 9.5826; 90; 90; 120;

COD ID: 2104888

Formula: - C6 H24 Cu N6 O4 S -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 665.293
Cell parameters: 8.9513; 8.9513; 9.5876; 90; 90; 120;

COD ID: 2104889

Formula: - C6 H24 Cu N6 O4 S -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 666.517
Cell parameters: 8.9572; 8.9572; 9.5926; 90; 90; 120;

COD ID: 2104890

Formula: - C6 H24 Cu N6 O4 S -
Comments: Smeets, Stef; Parois, Pascal; Bürgi, Hans-Beat; Lutz, Martin Temperature-dependent analysis of thermal motion, disorder and structures of tris(ethylenediamine)zinc(II) sulfate and tris(ethylenediamine)copper(II) sulfate Acta Crystallographica Section B 67(1) (2011) 53-62
Space group: P -3 1 c
Cell volume: 668.375
Cell parameters: 8.9664; 8.9664; 9.5996; 90; 90; 120;

COD ID: 2106884
CIF file	Formula: - Cr F5 H20 N2 O6 - Comments: Marsh, R.E.; Herbstein, F.H. Some additional changes in space groups of published crystal structures Acta Crystallographica B (39,1983-) 39 (1983) 280-287 Space group: P -3 1 c Cell volume: 564.065 Cell parameters: 6.927; 6.927; 13.574; 90; 90; 120;

COD ID: 2204047

Formula: - C22 H62 N3 O Si6 Sm -
Comments: Jörg Sundermeyer; Alexandre Khvorost; Klaus Harms Tris[bis(trimethylsilyl)amido]samarium tetrahydrofuran solvate Acta Crystallographica Section E 60(8) (2004) m1117-m1119
Space group: P -3 1 c
Cell volume: 1966
Cell parameters: 16.49; 16.49; 8.3485; 90; 90; 120;

COD ID: 2214515

Formula: - C18 H28 N12 Ni O6 S -
Comments: Xiao-Chang Sun; Guang-Peng Zhou; Zhao-Bin Liu; Yan Xu Hexakis(1H-imidazole-κN^3^)nickel(II) sulfate dihydrate Acta Crystallographica Section E 63(8) (2007) m2176-m2176
Space group: P -3 1 c
Cell volume: 1610
Cell parameters: 9.0029; 9.0029; 22.937; 90; 90; 120;

COD ID: 2226306

Formula: - C6 H24 Co N6 O4 S -
Comments: Yotnoi, Bunlawee; Seeharaj, Athittaya; Chimupala, Yothin; Rujiwatra, Apinpus Tris(ethylenediamine)cobalt(II) sulfate Acta Crystallographica Section E 66(6) (2010) m628
Space group: P -3 1 c
Cell volume: 671.71
Cell parameters: 8.992; 8.992; 9.5927; 90; 90; 120;

COD ID: 2234260

Formula: - C6 H24 Cd F6 Ge N6 -
Comments: Wang, Guo-Ming; Li, Zeng-Xin; Wang, Pei Tris(ethylenediamine-κ^2^N,N')cadmium hexafluoridogermanate Acta Crystallographica Section E 68(4) (2012) m396-m397
Space group: P -3 1 c
Cell volume: 788.37
Cell parameters: 9.5422; 9.5422; 9.9977; 90; 90; 120;

COD ID: 2238004

Formula: - K Mo12 Na2.9 S14 -
Comments: Gougeon, Patrick; Gall, Philippe; Salloum, Diala Na~2.9~KMo~12~S~14~: a novel quaternary reduced molybdenum sulfide containing Mo~12~ clusters with a channel structure Acta Crystallographica Section E 69(6) (2013) i38
Space group: P -3 1 c
Cell volume: 1238.26
Cell parameters: 9.3664; 9.3664; 16.2981; 90; 90; 120;

COD ID: 2311716

Formula: - Cu3.313 Si -
Comments: Corrêa, Cinthia Antunes; Perez, Olivier; Kopeček, Jaromír; Brázda, Petr; Klementová, Mariana; Palatinus, Lukáš Crystal structures of η''-Cu3+xSi and η'''-Cu3+xSi. Acta crystallographica Section B, Structural science, crystal engineering and materials 73(Pt 4) (2017) 767-774
Space group: P -3 1 c
Cell volume: 10059.6
Cell parameters: 16.2448; 16.2448; 44.017; 90; 90; 120;

COD ID: 2312152
CIF file HKL data	Formula: - Y Zn5.217 - Comments: Fredrickson, Rie T.; Fredrickson, Daniel C. As predicted and more: modulated channel occupation in YZn<sub>5+x</sub>. Acta crystallographica Section B, Structural science, crystal engineering and materials 79(4) (2023) Space group: P -3 1 c Cell volume: 628.812 Cell parameters: 8.8811; 8.8811; 9.2057; 90; 90; 120;

COD ID: 4000059

Formula: - C6 H28 Cl Co N6 O26 P6 Zn8 -
Comments: Yu, Jihong; Wang, Yu; Shi, Zhan; Xu, Ruren Hydrothermal Synthesis and Characterization of Two New Zinc Phosphates Assembled about a Chiral Metal Complex: [CoII(en)3]2[Zn6P8O32H8] and [CoIII(en)3][Zn8P6O24Cl].2H2O Chemistry of Materials 13(9) (2001) 2972-2978
Space group: P -3 1 c
Cell volume: 1622.7
Cell parameters: 8.8775; 8.8775; 23.775; 90; 90; 120;

COD ID: 4000836

Formula: - B2 Be2 Ca F K O6 -
Comments: Huang, Hongwei; Yao, Jiyong; Lin, Zheshuai; Wang, Xiaoyang; He, Ran; Yao, Wenjiao; Zhai, Naixia; Chen, Chuangtian Molecular Engineering Design to Resolve the Layering Habit and Polymorphism Problems in Deep UV NLO Crystals: New Structures in MM′Be2B2O6F (M═Na, M′═Ca; M═ K, M′═Ca, Sr) Chemistry of Materials 23(24) (2011) 5457
Space group: P -3 1 c
Cell volume: 279.07
Cell parameters: 4.7054; 4.7054; 14.554; 90; 90; 120;

COD ID: 4002279
CIF file	Formula: - Cr0.943 S2 V0.427 - Comments: Vaqueiro, P.; Powell, A.V. Structures and properties of new ordered defect phases in the vanadium chromium sulfide system Chemistry of Materials (1,1989-) 12 (2000) 2705-2714 Space group: P -3 1 c Cell volume: 339.323 Cell parameters: 5.908; 5.908; 11.2254; 90; 90; 120;

COD ID: 4002293
CIF file	Formula: - As10 Ba2 Cu15.34 - Comments: Kim, S.-J.; Kannewurf, C.R.; Ireland, J.; Kanatzidis, M.G. Ba2 Cu18-x As10: a new mixed-valent ternary copper-rich arsenide with metallic properties Chemistry of Materials (1,1989-) 12 (2000) 3133-3138 Space group: P -3 1 c Cell volume: 458.333 Cell parameters: 6.7329; 6.7329; 11.6747; 90; 90; 120;

COD ID: 4002759

Formula: - Ba Fe4 O7 -
Comments: Ferreira, Timothy; Morrison, Gregory; Chance, W. Michael; Calder, Stuart; Smith, Mark D.; zur Loye, Hans-Conrad BaFe4O7 and K0.22Ba0.89Fe4O7: Canted Antiferromagnetic Diferrites with Exceptionally High Magnetic Ordering Temperatures Chemistry of Materials 29(7) (2017) 2689
Space group: P -3 1 c
Cell volume: 317.17
Cell parameters: 5.1503; 5.1503; 13.8069; 90; 90; 120;

COD ID: 4002830

Formula: - Ba0.89 Fe4 K0.21 O7 -
Comments: Ferreira, Timothy; Morrison, Gregory; Chance, W. Michael; Calder, Stuart; Smith, Mark D.; zur Loye, Hans-Conrad BaFe4O7 and K0.22Ba0.89Fe4O7: Canted Antiferromagnetic Diferrites with Exceptionally High Magnetic Ordering Temperatures Chemistry of Materials 29(7) (2017) 2689
Space group: P -3 1 c
Cell volume: 317.68
Cell parameters: 5.1532; 5.1532; 13.8134; 90; 90; 120;

COD ID: 4003071

Formula: - C156 H220 I7 In9 N24 O66 -
Comments: Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation Chemistry of Materials 31(3) (2019) 1084
Space group: P -3 1 c
Cell volume: 11200
Cell parameters: 27.016; 27.016; 17.719; 90; 90; 120;

COD ID: 4003072

Formula: - C144 H193 Cl7 In9 N21 O63 -
Comments: Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation Chemistry of Materials 31(3) (2019) 1084
Space group: P -3 1 c
Cell volume: 11140
Cell parameters: 26.835; 26.835; 17.863; 90; 90; 120;

COD ID: 4003073

Formula: - C144 H193 Br7 In9 N21 O63 -
Comments: Yuan, Yang; Li, Jiantang; Sun, Xiaodong; Li, Guanghua; Liu, Yunling; Verma, Gaurav; Ma, Shengqian Indium‒Organic Frameworks Based on Dual Secondary Building Units Featuring Halogen-Decorated Channels for Highly Effective CO2 Fixation Chemistry of Materials 31(3) (2019) 1084
Space group: P -3 1 c
Cell volume: 11187
Cell parameters: 26.945; 26.945; 17.792; 90; 90; 120;

COD ID: 4003254
CIF file	Formula: - C6.13 H13.23 Al4 N1.4 O16 P3 Si - Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998 Space group: P -3 1 c Cell volume: 3249.82 Cell parameters: 13.61328; 13.61328; 20.249; 90; 90; 120;

COD ID: 4003255
CIF file	Formula: - Al O4 P0.75 Si0.25 - Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998 Space group: P -3 1 c Cell volume: 3239.95 Cell parameters: 13.7594; 13.7594; 19.761; 90; 90; 120;

COD ID: 4003258
CIF file	Formula: - Al12 O48 P8.4 Si3.6 - Comments: Turrina, Alessandro; Garcia, Raquel; Cox, Paul A.; Casci, John L.; Wright, Paul A. Retrosynthetic Co-Templating Method for the Preparation of Silicoaluminophosphate Molecular Sieves Chemistry of Materials 28(14) (2016) 4998 Space group: P -3 1 c Cell volume: 1636.87 Cell parameters: 13.8077; 13.8077; 9.9138; 90; 90; 120;

COD ID: 4003331

Formula: - C1.29 H3.01 Al N0.33 O4.09 P0.95 Si0.05 -
Comments: Turrina, Alessandro; Garcia, Raquel; Watts, Abigail E.; Greer, Heather F.; Bradley, Jonathan; Zhou, Wuzong; Cox, Paul A.; Shannon, Mervyn D.; Mayoral, Alvaro; Casci, John L.; Wright, Paul A. STA-20: An ABC-6 Zeotype Structure Prepared by Co-Templating and Solved via a Hypothetical Structure Database and STEM-ADF Imaging Chemistry of Materials 29(5) (2017) 2180
Space group: P -3 1 c
Cell volume: 4522.96
Cell parameters: 13.17398; 13.17398; 30.0925; 90; 90; 120;

COD ID: 4003332

Formula: - Al O4 P0.95 Si0.05 -
Comments: Turrina, Alessandro; Garcia, Raquel; Watts, Abigail E.; Greer, Heather F.; Bradley, Jonathan; Zhou, Wuzong; Cox, Paul A.; Shannon, Mervyn D.; Mayoral, Alvaro; Casci, John L.; Wright, Paul A. STA-20: An ABC-6 Zeotype Structure Prepared by Co-Templating and Solved via a Hypothetical Structure Database and STEM-ADF Imaging Chemistry of Materials 29(5) (2017) 2180
Space group: P -3 1 c
Cell volume: 4583.47
Cell parameters: 13.15497; 13.15497; 30.5833; 90; 90; 120;

COD ID: 4029167

Formula: - C90 H84 K2 N20 O51 P -
Comments: Basu, Arghya; Das, Gopal A C3v-Symmetric Tripodal Urea Receptor for Anions and Ion Pairs: Formation of Dimeric Capsular Assemblies of the Receptor during Anion and Ion Pair Coordination. The Journal of organic chemistry 79(6) (2014) 2647-2656
Space group: P -3 1 c
Cell volume: 5903.4
Cell parameters: 17.3549; 17.3549; 22.6324; 90; 90; 120;

COD ID: 4085766

Formula: - C90 H96 Fe2 N6 Na2 O12 -
Comments: Li, Lihong; Clarkson, Guy J.; Lees, Martin R.; Howson, Suzanne E.; Tan, Sze-yin; Turner, Scott S.; Scott, Peter Iron and Manganese Complexes of 2-Carbonyl Pyrrolyls: Scorpionate Sandwich Anions and Extended Structures Organometallics 34(11) (2015) 2543
Space group: P -3 1 c
Cell volume: 4220.62
Cell parameters: 13.1187; 13.1187; 28.3181; 90; 90; 120;

COD ID: 4086889

Formula: - C37 H53 Cl N4 Pd -
Comments: García-López, José Antonio; Frutos-Pedreño, Roberto; Bautista, Delia; Saura-Llamas, Isabel; Vicente, José Norbornadiene as a Building Block for the Synthesis of Linked Benzazocinones and Benzazocinium Salts through Tetranuclear Carbopalladated Intermediates Organometallics 36(2) (2017) 372
Space group: P -3 1 c
Cell volume: 12709.9
Cell parameters: 25.4325; 25.4325; 22.69; 90; 90; 120;

COD ID: 4104494

Formula: - C8 H18 Fe2 N O12 -
Comments: Karl S. Hagen; Sunil G. Naik; Boi Hanh Huynh; Antonio Masello; George Christou Intensely Colored Mixed-Valence Iron(II) Iron(III) Formate Analogue of Prussian Blue Exhibits Néel N-Type Ferrimagnetism Journal of the American Chemical Society 131 (2009) 7516-7517
Space group: P -3 1 c
Cell volume: 816.4
Cell parameters: 8.2512; 8.2512; 13.846; 90; 90; 120;

COD ID: 4106473
CIF file	Formula: - C32 H40 Li O8 Si3 U - Comments: Skye Fortier; Justin R. Walensky; Guang Wu; Trevor W. Hayton High-Valent Uranium Alkyls: Evidence for the Formation of UVI(CH2SiMe3)6 Journal of the American Chemical Society 133 (2011) 11732-11743 Space group: P -3 1 c Cell volume: 2383.2 Cell parameters: 13.0591; 13.0591; 16.136; 90; 90; 120;

COD ID: 4109774

Formula: - C80 H154 Fe12 O50 -
Comments: Theocharis C. Stamatatos; Alexander G. Christou; Candace M. Jones; Brian J. O'Callaghan; Khalil A. Abboud; Ted A. O'Brien; George Christou "Squaring the Circle": Molecular Squares and Rectangles from Chelate-Induced Structural Transformations of Known Fe10 and New Fe12 Ferric Wheels Journal of the American Chemical Society 129 (2007) 9840-9841
Space group: P -3 1 c
Cell volume: 5733
Cell parameters: 19.248; 19.248; 17.868; 90; 90; 120;

COD ID: 4110784
CIF file	Formula: - C21 H17 N1.33 - Comments: P. S. Lakshminarayanan; D. Krishna Kumar; Pradyut Ghosh Solid State Structural Evidence of Chloroform-Benzene-Chloroform Adduct Trapped in Hexaanthryl Octaaminocryptand Channels Journal of the American Chemical Society 128 (2006) 9600-9601 Space group: P -3 1 c Cell volume: 5355.6 Cell parameters: 15.2238; 15.2238; 26.683; 90; 90; 120;

COD ID: 4110785

Formula: - C22.33 H18.33 Cl N1.33 -
Comments: P. S. Lakshminarayanan; D. Krishna Kumar; Pradyut Ghosh Solid State Structural Evidence of Chloroform-Benzene-Chloroform Adduct Trapped in Hexaanthryl Octaaminocryptand Channels Journal of the American Chemical Society 128 (2006) 9600-9601
Space group: P -3 1 c
Cell volume: 5397.3
Cell parameters: 15.5002; 15.5002; 25.94; 90; 90; 120;

COD ID: 4114018

Formula: - C85 H125 B2 F8 N18 Na5 Ni9 O42 -
Comments: Xiang Lin; Dan M. J. Doble; Alexander J. Blake; Andrew Harrison; Claire Wilson; Martin Schröder Cationic Assembly of Metal Complex Aggregates: Structural Diversity, Solution Stability, and Magnetic Properties Journal of the American Chemical Society 125 (2003) 9476-9483
Space group: P -3 1 c
Cell volume: 6168.2
Cell parameters: 16.9608; 16.9608; 24.7593; 90; 90; 120;

COD ID: 4114711
CIF file	Formula: - C108 H237 F36 N6 O9.5 P15 Re18 Sb6 Se24 - Comments: Bryan K. Roland; Hugh D. Selby; Michael D. Carducci; Zhiping Zheng Built to Order: Molecular Tinkertoys from the [Re6(μ3-Se)8]2+ Clusters Journal of the American Chemical Society 124 (2002) 3222-3223 Space group: P -3 1 c Cell volume: 22822 Cell parameters: 26.493; 26.493; 37.545; 90; 90; 120;

COD ID: 4114932
CIF file	Formula: - C72 H126 Cl3 K Mn Mo6 N36 O12 - Comments: Jennifer J. Sokol; Allan G. Hee; Jeffrey R. Long A Cyano-Bridged Single-Molecule Magnet: Slow Magnetic Relaxation in a Trigonal Prismatic MnMo6(CN)18 Cluster Journal of the American Chemical Society 124 (2002) 7656-7657 Space group: P -3 1 c Cell volume: 4936.2 Cell parameters: 14.2312; 14.2312; 28.1433; 90; 90; 120;

COD ID: 4118946

Formula: - C8 H14 Fe2 N O12 -
Comments: Laura Cañadillas-Delgado; Oscar Fabelo; J. Alberto Rodríguez-Velamazán; Marie-Hélène Lemée-Cailleau; Sax A. Mason; Emilio Pardo; Francesc Lloret; Jiong-Peng Zhao; Xian-He Bu; Virginie Simonet; Claire V. Colin; Juan Rodríguez-Carvajal The Role of Order-Disorder Transitions in the Quest for Molecular Multiferroics: Structural and Magnetic Neutron Studies of a Mixed Valence Iron(II)-Iron(III) Formate Framework Journal of the American Chemical Society 134 (2012) 19772-19781
Space group: P -3 1 c
Cell volume: 819.8
Cell parameters: 8.255; 8.255; 13.891; 90; 90; 120;

COD ID: 4118947

Formula: - C8 H14 Fe2 N O12 -
Comments: Laura Cañadillas-Delgado; Oscar Fabelo; J. Alberto Rodríguez-Velamazán; Marie-Hélène Lemée-Cailleau; Sax A. Mason; Emilio Pardo; Francesc Lloret; Jiong-Peng Zhao; Xian-He Bu; Virginie Simonet; Claire V. Colin; Juan Rodríguez-Carvajal The Role of Order-Disorder Transitions in the Quest for Molecular Multiferroics: Structural and Magnetic Neutron Studies of a Mixed Valence Iron(II)-Iron(III) Formate Framework Journal of the American Chemical Society 134 (2012) 19772-19781
Space group: P -3 1 c
Cell volume: 816.32
Cell parameters: 8.2485; 8.2485; 13.8542; 90; 90; 120;

COD ID: 4120119

Formula: - C42 H24 In3 N0 O16 -
Comments: Shou-Tian Zheng; Xiang Zhao; Samuel Lau; Addis Fuhr; Pingyun Feng; Xianhui Bu Entrapment of Metal Clusters in Metal-Organic Framework Channels by Extended Hooks Anchored at Open Metal Sites Journal of the American Chemical Society 135 (2013) 10270-10273
Space group: P -3 1 c
Cell volume: 8697.8
Cell parameters: 20.8131; 20.8131; 23.185; 90; 90; 120;

COD ID: 4120120

Formula: - C60 H38 In3 N3 O20 Zn -
Comments: Shou-Tian Zheng; Xiang Zhao; Samuel Lau; Addis Fuhr; Pingyun Feng; Xianhui Bu Entrapment of Metal Clusters in Metal-Organic Framework Channels by Extended Hooks Anchored at Open Metal Sites Journal of the American Chemical Society 135 (2013) 10270-10273
Space group: P -3 1 c
Cell volume: 7647.6
Cell parameters: 18.7843; 18.7843; 25.0267; 90; 90; 120;

COD ID: 4120121

Formula: - C60 H36 Co2 In3 N3 O22 -
Comments: Shou-Tian Zheng; Xiang Zhao; Samuel Lau; Addis Fuhr; Pingyun Feng; Xianhui Bu Entrapment of Metal Clusters in Metal-Organic Framework Channels by Extended Hooks Anchored at Open Metal Sites Journal of the American Chemical Society 135 (2013) 10270-10273
Space group: P -3 1 c
Cell volume: 7612.6
Cell parameters: 18.8658; 18.8658; 24.6975; 90; 90; 120;

COD ID: 4123338

Formula: - C54 H24 N6 Ni3 O13 -
Comments: Zhao, Xiang; Bu, Xianhui; Zhai, Quan-Guo; Tran, Huy; Feng, Pingyun Pore space partition by symmetry-matching regulated ligand insertion and dramatic tuning on carbon dioxide uptake. Journal of the American Chemical Society 137(4) (2015) 1396-1399
Space group: P -3 1 c
Cell volume: 3694.25
Cell parameters: 16.7342; 16.7342; 15.233; 90; 90; 120;

COD ID: 4123339

Formula: - C54 H30 N6 Ni3 O13 -
Comments: Zhao, Xiang; Bu, Xianhui; Zhai, Quan-Guo; Tran, Huy; Feng, Pingyun Pore space partition by symmetry-matching regulated ligand insertion and dramatic tuning on carbon dioxide uptake. Journal of the American Chemical Society 137(4) (2015) 1396-1399
Space group: P -3 1 c
Cell volume: 5030.76
Cell parameters: 16.6706; 16.6706; 20.9026; 90; 90; 120;

COD ID: 4123443

Formula: - C216 H72 F12 N0 O52 Zn16 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35879
Cell parameters: 37.1295; 37.1295; 30.052; 90; 90; 120;

COD ID: 4123444

Formula: - C172.5 H115.5 O38 Zn8 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35868.3
Cell parameters: 37.1842; 37.1842; 29.9546; 90; 90; 120;

COD ID: 4123445

Formula: - C54 H36 N6 O13 Zn4 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35893
Cell parameters: 37.149; 37.149; 30.032; 90; 90; 120;

COD ID: 4123447

Formula: - C78 H30 O13 Zn4 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35029
Cell parameters: 36.78; 36.78; 29.9; 90; 90; 120;

COD ID: 4123448

Formula: - C121 H64.15 N4 O26 Zn8 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35725
Cell parameters: 37.09; 37.09; 29.987; 90; 90; 120;

COD ID: 4123449

Formula: - C108 H36 F24 N0 O26 Zn8 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 36184
Cell parameters: 37.227; 37.227; 30.149; 90; 90; 120;

COD ID: 4123450

Formula: - C54 H25.69 F3.8 O13 Zn4 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35808
Cell parameters: 37.099; 37.099; 30.042; 90; 90; 120;

COD ID: 4123451

Formula: - C114 H54 N0 O26 Zn8 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35762
Cell parameters: 37.083; 37.083; 30.0291; 90; 90; 120;

COD ID: 4123453

Formula: - C115.5 H67.5 O33.5 Zn8 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35908.8
Cell parameters: 37.151; 37.151; 30.042; 90; 90; 120;

COD ID: 4123454

Formula: - C108 H60 N12 O26 Zn8 -
Comments: Zhang, Yue-Biao; Furukawa, Hiroyasu; Ko, Nakeun; Nie, Weixuan; Park, Hye Jeong; Okajima, Satoshi; Cordova, Kyle E.; Deng, Hexiang; Kim, Jaheon; Yaghi, Omar M. Introduction of functionality, selection of topology, and enhancement of gas adsorption in multivariate metal-organic framework-177. Journal of the American Chemical Society 137(7) (2015) 2641-2650
Space group: P -3 1 c
Cell volume: 35912.2
Cell parameters: 37.1916; 37.1916; 29.9793; 90; 90; 120;

COD ID: 4123758

Formula: - C51 H48 I6 Mn6 N12 O20 -
Comments: Nguyen, Tu N.; Shiddiq, Muhandis; Ghosh, Tuhin; Abboud, Khalil A.; Hill, Stephen; Christou, George Covalently Linked Dimer of Mn3 Single-Molecule Magnets and Retention of Its Structure and Quantum Properties in Solution. Journal of the American Chemical Society 137(22) (2015) 7160-7168
Space group: P -3 1 c
Cell volume: 4347.3
Cell parameters: 16.5692; 16.5692; 18.2847; 90; 90; 120;

COD ID: 4129837
CIF file	Formula: - C54 H30 O13 Zn4 - Comments: Feng, Yongqiang; Wang, Taishan; Li, Yongjian; Li, Jie; Wu, Jingyi; Wu, Bo; Jiang, Li; Wang, Chunru Steering Metallofullerene Electron Spin in Porous Metal-Organic Framework. Journal of the American Chemical Society 137(47) (2015) 15055-15060 Space group: P -3 1 c Cell volume: 36020 Cell parameters: 37.166; 37.166; 30.111; 90; 90; 120;

COD ID: 4130553

Formula: - C336 H210 Ag30 Au80 Cl15 -
Comments: Zeng, Jiu-Lian; Guan, Zong-Jie; Du, Yang; Nan, Zi-Ang; Lin, Yu-Mei; Wang, Quan-Ming Chloride-Promoted Formation of a Bimetallic Nanocluster Au80Ag30 and the Total Structure Determination. Journal of the American Chemical Society 138(25) (2016) 7848-7851
Space group: P -3 1 c
Cell volume: 24966.3
Cell parameters: 30.5957; 30.5957; 30.7966; 90; 90; 120;

COD ID: 4130924
CIF file	Formula: - C42 H6 Cl4 Co2 In3 N9 O16 - Comments: Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun Multivariable Modular Design of Pore Space Partition. Journal of the American Chemical Society 138(46) (2016) 15102-15105 Space group: P -3 1 c Cell volume: 3859.5 Cell parameters: 13.8392; 13.8392; 23.269; 90; 90; 120;

COD ID: 4135540

Formula: - C284 H330 N54 O88 Pd6 -
Comments: Cai, Li-Xuan; Yan, Dan-Ni; Cheng, Pei-Ming; Xuan, Jin-Jin; Li, Shao-Chuan; Zhou, Li-Peng; Tian, Chong-Bin; Sun, Qing-Fu Controlled Self-Assembly and Multistimuli-Responsive Interconversions of Three Conjoined Twin-Cages. Journal of the American Chemical Society (2021)
Space group: P -3 1 c
Cell volume: 29888.1
Cell parameters: 28.7906; 28.7906; 41.6357; 90; 90; 120;

COD ID: 4300602
CIF file	Formula: - K2.3 Mo12 S14 - Comments: Inorganic Chemistry (2006) Space group: P -3 1 c Cell volume: 1195 Cell parameters: 9.172; 9.172; 16.403; 90; 90; 120;

COD ID: 4300603
CIF file	Formula: - K2.12 Mo12 S14 - Comments: Inorganic Chemistry (2006) Space group: P -3 1 c Cell volume: 1189.99 Cell parameters: 9.1476; 9.1476; 16.421; 90; 90; 120;

COD ID: 4300604
CIF file	Formula: - K2.57 Mo12 S14 - Comments: Inorganic Chemistry (2006) Space group: P -3 1 c Cell volume: 1203.8 Cell parameters: 9.199; 9.199; 16.426; 90; 90; 120;

COD ID: 4300605
CIF file	Formula: - K Mo12 S14 - Comments: Inorganic Chemistry (2006) Space group: P -3 1 c Cell volume: 1171.8 Cell parameters: 9.0797; 9.0797; 16.412; 90; 90; 120;

COD ID: 4303040

Formula: - Cs1.15 Mo12 S14 -
Comments: Patrick Gougeon; Diala Salloum; Jérôme Cuny; Laurent Le Pollès; Marie Le Floch; Régis Gautier; Michel Potel Synthesis, Electronic and Crystal Structures, and Physical Studies of the Superconductor Cs~1Mo12S14, Final Step of the Condensation of the Mo6L8iL6a Unit Inorganic Chemistry 48 (2009) 8337-8341
Space group: P -3 1 c
Cell volume: 549.64
Cell parameters: 9.9793; 9.9793; 6.373; 90; 90; 120;

COD ID: 4304210
CIF file	Formula: - C23 H66 N3 Pu Si6 - Comments: Andrew J. Gaunt; Alejandro E. Enriquez; Sean D. Reilly; Brian L. Scott; Mary P. Neu Structural Characterization of Pu[N(SiMe3)2]3, a Synthetically Useful Nonaqueous Plutonium(III) Precursor Inorganic Chemistry 47 (2008) 26-28 Space group: P -3 1 c Cell volume: 1935.6 Cell parameters: 16.404; 16.404; 8.306; 90; 90; 120;

COD ID: 4304905
CIF file	Formula: - C52 H80 Al2 O4 Yb - Comments: Hanne-Marthe Sommerfeldt; Christian Meermann; Karl W. Törnroos; Reiner Anwander Distinct Reaction Pathways of Peralkylated LnIIAlIII Heterobimetallic Complexes with Substituted Phenols Inorganic Chemistry 47 (2008) 4696-4705 Space group: P -3 1 c Cell volume: 16614.9 Cell parameters: 20.9364; 20.9364; 43.7686; 90; 90; 120;

COD ID: 4306607

Formula: - C12 H18 Cl4 Na20 Ni8 O115.5 Si2 W18 -
Comments: Céline Pichon; Pierre Mialane; Anne Dolbecq; Jérôme Marrot; Eric Rivière; Bassem S. Bassil; Ulrich Kortz; Bineta Keita; Louis Nadjo; Francis Sécheresse Octa- and Nonanuclear Nickel(II) Polyoxometalate Clusters: Synthesis and Electrochemical and Magnetic Characterizations Inorganic Chemistry 47 (2008) 11120-11128
Space group: P -3 1 c
Cell volume: 5971.61
Cell parameters: 11.9272; 11.9272; 48.4712; 90; 90; 120;

COD ID: 4307749
CIF file	Formula: - C18 H22.5 Cu La1.5 N6 O20 - Comments: Feng-Qin Wang; Xiang-Jun Zheng; Yong-Hong Wan; Chang-Yan Sun; Zhe-Ming Wang; Ke-Zhi Wang; Lin-Pei Jin Novel 3D LnIII-CuI Supramolecular Architecture Based on 2D MOFs with (6,3) Topology Inorganic Chemistry 46 (2007) 2956-2958 Space group: P -3 1 c Cell volume: 1327.9 Cell parameters: 12.814; 12.814; 9.338; 90; 90; 120;

COD ID: 4307750
CIF file	Formula: - C18 H22.5 Cu Eu1.5 N6 O20 - Comments: Feng-Qin Wang; Xiang-Jun Zheng; Yong-Hong Wan; Chang-Yan Sun; Zhe-Ming Wang; Ke-Zhi Wang; Lin-Pei Jin Novel 3D LnIII-CuI Supramolecular Architecture Based on 2D MOFs with (6,3) Topology Inorganic Chemistry 46 (2007) 2956-2958 Space group: P -3 1 c Cell volume: 1317.3 Cell parameters: 12.659; 12.659; 9.492; 90; 90; 120;

COD ID: 4307751
CIF file	Formula: - C18 H22.5 Cu Gd1.5 N6 O20 - Comments: Feng-Qin Wang; Xiang-Jun Zheng; Yong-Hong Wan; Chang-Yan Sun; Zhe-Ming Wang; Ke-Zhi Wang; Lin-Pei Jin Novel 3D LnIII-CuI Supramolecular Architecture Based on 2D MOFs with (6,3) Topology Inorganic Chemistry 46 (2007) 2956-2958 Space group: P -3 1 c Cell volume: 1304.1 Cell parameters: 12.6203; 12.6203; 9.4547; 90; 90; 120;

COD ID: 4309426
CIF file	Formula: - C36 H57 Cl3 Cu2 N8 O14 - Comments: Andrew D. Bond; Sofia Derossi; Frank Jensen; Frank B. Larsen; Christine J. McKenzie; Jane Nelson Squeezing the [Cu-OH...H2O-Cu]3+ Bridge by Cryptate Encapsulation Inorganic Chemistry 44 (2005) 5987-5989 Space group: P -3 1 c Cell volume: 2164 Cell parameters: 9.8716; 9.8716; 25.642; 90; 90; 120;

COD ID: 4309668
CIF file	Formula: - C24 H81 N6 O48 P12 Ru6 - Comments: Bin Liu; Yi-Zhi Li; Li-Min Zheng Mixed-Valent Diruthenium Diphosphonate with Kagomé Structure Inorganic Chemistry 44 (2005) 6921-6923 Space group: P -3 1 c Cell volume: 3581.5 Cell parameters: 14.3827; 14.3827; 19.992; 90; 90; 120;

COD ID: 4312283
CIF file	Formula: - C150 H140 N6 O19 P6 Rh6 - Comments: F. Albert Cotton; Carlos A. Murillo; Xiaoping Wang; Rongmin Yu Chiral Organometallic Triangles with Rh-Rh Bonds. 1. Compounds Prepared from Racemic cis-Rh2(C6H4PPh2)2(OAc)2 Inorganic Chemistry 43 (2004) 8394-8403 Space group: P -3 1 c Cell volume: 6705 Cell parameters: 19.1896; 19.1896; 21.0249; 90; 90; 120;

COD ID: 4317033

Formula: - C8 H14 Fe2 N O12 -
Comments: Jiong-Peng Zhao; Bo-Wen Hu; Francesc Lloret; Jun Tao; Qian Yang; Xiao-Feng Zhang; Xian-He Bu Magnetic Behavior Control in Niccolite Structural Metal Formate Frameworks [NH2(CH3)2][FeIIIMII(HCOO)6] (M = Fe, Mn, and Co) by Varying the Divalent Metal Ions Inorganic Chemistry 49 (2010) 10390-10399
Space group: P -3 1 c
Cell volume: 825.1
Cell parameters: 8.2699; 8.2699; 13.93; 90; 90; 120;

COD ID: 4317034

Formula: - C8 H14 Fe2 N O12 -
Comments: Jiong-Peng Zhao; Bo-Wen Hu; Francesc Lloret; Jun Tao; Qian Yang; Xiao-Feng Zhang; Xian-He Bu Magnetic Behavior Control in Niccolite Structural Metal Formate Frameworks [NH2(CH3)2][FeIIIMII(HCOO)6] (M = Fe, Mn, and Co) by Varying the Divalent Metal Ions Inorganic Chemistry 49 (2010) 10390-10399
Space group: P -3 1 c
Cell volume: 813.1
Cell parameters: 8.2366; 8.2366; 13.84; 90; 90; 120;

COD ID: 4317035

Formula: - C8 H14 Fe Mn N O12 -
Comments: Jiong-Peng Zhao; Bo-Wen Hu; Francesc Lloret; Jun Tao; Qian Yang; Xiao-Feng Zhang; Xian-He Bu Magnetic Behavior Control in Niccolite Structural Metal Formate Frameworks [NH2(CH3)2][FeIIIMII(HCOO)6] (M = Fe, Mn, and Co) by Varying the Divalent Metal Ions Inorganic Chemistry 49 (2010) 10390-10399
Space group: P -3 1 c
Cell volume: 838.3
Cell parameters: 8.3151; 8.3151; 14.001; 90; 90; 120;

COD ID: 4317036

Formula: - C8 H14 Co Fe N O12 -
Comments: Jiong-Peng Zhao; Bo-Wen Hu; Francesc Lloret; Jun Tao; Qian Yang; Xiao-Feng Zhang; Xian-He Bu Magnetic Behavior Control in Niccolite Structural Metal Formate Frameworks [NH2(CH3)2][FeIIIMII(HCOO)6] (M = Fe, Mn, and Co) by Varying the Divalent Metal Ions Inorganic Chemistry 49 (2010) 10390-10399
Space group: P -3 1 c
Cell volume: 812.6
Cell parameters: 8.2486; 8.2486; 13.79; 90; 90; 120;

COD ID: 4319477
CIF file	Formula: - Ga H4.8 Na O8.4 Te2 - Comments: N. S. P. Bhuvanesh; P. Shiv Halasyamani Synthesis and Characterization of NaGaTe2O6.2.4H2O: A New Open-Framework Tellurite Related to Zemannite Inorganic Chemistry 40 (2001) 1404-1405 Space group: P -3 1 c Cell volume: 1229.2 Cell parameters: 9.216; 9.216; 16.711; 90; 90; 120;

COD ID: 4320145

Formula: - C72 H120 Cu12 P6 Te9 -
Comments: Marty W. DeGroot; Michael W. Cockburn; Mark S. Workentin; John F. Corrigan Trialkylphosphine-Stabilized Copper-Phenyltellurolate Complexes: From Small Molecules to Nanoclusters via Condensation Reactions Inorganic Chemistry 40 (2001) 4678-4685
Space group: P -3 1 c
Cell volume: 4978.1
Cell parameters: 15.345; 15.345; 24.412; 90; 90; 120;

COD ID: 4320308
CIF file	Formula: - Cl18 Cs2 Nb6 O6 Ti4 - Comments: Ekaterina V. Anokhina; Cynthia S. Day; Abdessadek Lachgar A New Quasi-One-Dimensional Niobium Oxychloride Cluster Compound Cs2Ti4Nb6Cl18O6: Structural Effects of Ligand Combination Inorganic Chemistry 40 (2001) 5072-5076 Space group: P -3 1 c Cell volume: 1691.8 Cell parameters: 11.1903; 11.1903; 15.6; 90; 90; 120;

COD ID: 4320310

Formula: - Li24 Mn3 N11 -
Comments: Niewa, R.; Hochrein, O.; Schnelle, W.; Wagner, F.R.; Kniep, R. Li~24~[MnN~3~]~3~N~2~ and Li~5~[(Li~1-x~Mn~x~)N]~3~, Two Intermediates in the Decomposition Path of Li~7~[MnN~4~] to Li~2~[(Li~1-x~Mn~x~)N]: An Experimental and Theoretical Study Inorganic Chemistry 40(20) (2001) 5215-5222
Space group: P -3 1 c
Cell volume: 524.4
Cell parameters: 5.8258; 5.8258; 17.841; 90; 90; 120;

COD ID: 4320799
CIF file	Formula: - Cl6 Cs2 Os2 Re4 Se8 - Comments: Eric G. Tulsky; Jeffrey R. Long Heterometal Substitution in the Dimensional Reduction of Cluster Frameworks: Synthesis of Soluble [Re6-nOsnSe8Cl6](4-n) (n = 1-3) Cluster-Containing Solids Inorganic Chemistry 40 (2001) 6990-7002 Space group: P -3 1 c Cell volume: 1182.83 Cell parameters: 9.8333; 9.8333; 14.1252; 90; 90; 120;

COD ID: 4324612
CIF file	Formula: - Ge2 H N O38 U11 - Comments: Jessica M. Morrison; Laura J. Moore-Shay; Peter C. Burns U(VI) Uranyl Cation-Cation Interactions in Framework Germanates Inorganic Chemistry 50 (2011) 2272-2277 Space group: P -3 1 c Cell volume: 1583.69 Cell parameters: 10.2525; 10.2525; 17.3972; 90; 90; 120;

COD ID: 4324613
CIF file	Formula: - Ba Ge2 O38 U11 - Comments: Jessica M. Morrison; Laura J. Moore-Shay; Peter C. Burns U(VI) Uranyl Cation-Cation Interactions in Framework Germanates Inorganic Chemistry 50 (2011) 2272-2277 Space group: P -3 1 c Cell volume: 1546.23 Cell parameters: 10.2012; 10.2012; 17.157; 90; 90; 120;

COD ID: 4324614
CIF file	Formula: - Ge2 H K O38 U11 - Comments: Jessica M. Morrison; Laura J. Moore-Shay; Peter C. Burns U(VI) Uranyl Cation-Cation Interactions in Framework Germanates Inorganic Chemistry 50 (2011) 2272-2277 Space group: P -3 1 c Cell volume: 1553.1 Cell parameters: 10.226; 10.226; 17.15; 90; 90; 120;

COD ID: 4324615
CIF file	Formula: - Ge2 Li3 O39 U11 - Comments: Jessica M. Morrison; Laura J. Moore-Shay; Peter C. Burns U(VI) Uranyl Cation-Cation Interactions in Framework Germanates Inorganic Chemistry 50 (2011) 2272-2277 Space group: P -3 1 c Cell volume: 1556.94 Cell parameters: 10.2668; 10.2668; 17.0558; 90; 90; 120;

COD ID: 4326115

Formula: - C59 H57 Ag3 B3 F12 N13 O12 -
Comments: Vincent J. Catalano; Lyndsay B. Munro; Christoph E. Strasser; Ahmad F. Samin Modulation of Metal-Metal Separations in a Series of Ag(I) and Intensely Blue Photoluminescent Cu(I) NHC-Bridged Triangular Clusters Inorganic Chemistry 50 (2011) 8465-8476
Space group: P -3 1 c
Cell volume: 3110.75
Cell parameters: 13.4196; 13.4196; 19.946; 90; 90; 120;

COD ID: 4327330

Formula: - Bi Cu P2 Se6 -
Comments: Matthew A. Gave; Daniel Bilc; S. D. Mahanti; Jean D. Breshears; Mercouri G. Kanatzidis On the Lamellar Compounds CuBiP2Se6, AgBiP2Se6 and AgBiP2S6. Antiferroelectric Phase Transitions Due to Cooperative Cu+ and Bi3+ Ion Motion Inorganic Chemistry 44 (2005) 5293-5303
Space group: P -3 1 c
Cell volume: 491.43
Cell parameters: 6.541; 6.541; 13.263; 90; 90; 120;

COD ID: 4327611

Formula: - C31 H65 Cl4 Fe3 O18 -
Comments: Remle Çelenligil-Çetin; Richard J. Staples; Pericles Stavropoulos Synthesis, Characterization, and Reactivity of Ferrous and Ferric Oxo/Peroxo Pivalate Complexes in Relation to Gif-Type Oxygenation of Substrates Inorganic Chemistry 39 (2000) 5838-5846
Space group: P -3 1 c
Cell volume: 3055.74
Cell parameters: 12.288; 12.288; 23.3681; 90; 90; 120;

COD ID: 4329446

Formula: - C43 H86 Cl3 Cu8 F6 N6 P S12 -
Comments: Ping-Kuei Liao; Ching-Shiang Fang; Alison J. Edwards; Samia Kahlal; Jean-Yves Saillard; C. W. Liu Hydrido Copper Clusters Supported by Dithiocarbamates: Oxidative Hydride Removal and Neutron Diffraction Analysis of [Cu7(H){S2C(aza-15-crown-5)}6] Inorganic Chemistry 51 (2012) 6577-6591
Space group: P -3 1 c
Cell volume: 7506.9
Cell parameters: 15.2054; 15.2054; 37.4914; 90; 90; 120;

COD ID: 4331401
CIF file	Formula: - Ag P2 S6 Sc - Comments: Lee, S.; Colombet, P.; Ouvrard, G.; Brec, R. General trends observed in the substituted thiophosphate family. Synthesis and structure of Ag Sc P2 S6 and Cd Fe P2 S6. Inorganic Chemistry 27 (1988) 1291-1294 Space group: P -3 1 c Cell volume: 425.693 Cell parameters: 6.1736; 6.1736; 12.897; 90; 90; 120;

COD ID: 4332265

Formula: - Ag Cl H12 N4 O4 -
Comments: Nilsson, Kersti B.; Persson, Ingmar; Kessler, Vadim G. Coordination Chemistry of the Solvated AgIand AuIIons in Liquid and Aqueous Ammonia, Trialkyl and Triphenyl Phosphite, and Tri-n-butylphosphine Solutions Inorganic Chemistry 45(17) (2006) 6912-6921
Space group: P -3 1 c
Cell volume: 385.2
Cell parameters: 8.237; 8.237; 6.555; 90; 90; 120;

COD ID: 4333167

Formula: - C12 H8 B2 K N12 Na S12 -
Comments: Silva, Rosalice M.; Gwengo, Chengeto; Lindeman, Sergey V.; Smith, Mark D.; Gardinier, James R. Janus Scorpionates: Supramolecular Tectons for the Directed Assembly of Hard−Soft Alkali Metallopolymer Chains Inorganic Chemistry 45(26) (2006) 10998-11007
Space group: P -3 1 c
Cell volume: 1692.4
Cell parameters: 11.7151; 11.7151; 14.239; 90; 90; 120;

COD ID: 4334016

Formula: - C72 H168 Ce2 Mn2 N6 O20 P12 -
Comments: Guo-Cang Wang; Herman H. Y. Sung; Feng-Rong Dai; Wai-Hang Chiu; Wai-Yeung Wong; Ian D. Williams; Wa-Hung Leung Heterometallic Cerium(IV) Perrhenate, Permanganate, and Molybdate Complexes Supported by the Imidodiphosphinate Ligand [N(i-Pr2PO)2]- Inorganic Chemistry 52 (2013) 2556-2563
Space group: P -3 1 c
Cell volume: 5256.99
Cell parameters: 12.5734; 12.5734; 38.3973; 90; 90; 120;

COD ID: 4337719

Formula: - C76 H104 Cl4 Hg2 N12 O P12 -
Comments: Kornev, Alexander N.; Sushev, Vyacheslav V.; Panova, Yulia S.; Lukoyanova, Olga V.; Ketkov, Sergey Yu; Baranov, Evgenii V.; Fukin, Georgy K.; Lopatin, Mikhail A.; Budnikova, Yulia G.; Abakumov, Gleb A. N,N'-fused bisphosphole: heteroaromatic molecule with two-coordinate and formally divalent phosphorus. Synthesis, electronic structure, and chemical properties. Inorganic chemistry 53(6) (2014) 3243-3252
Space group: P -3 1 c
Cell volume: 4209.6
Cell parameters: 11.9905; 11.9905; 33.8096; 90; 90; 120;

COD ID: 4339601

Formula: - C10 H20 Mn2 N2 O12 -
Comments: Wang, Zheming; Zhang, Xueyu; Batten, Stuart R.; Kurmoo, Mohamedally; Gao, Song [CH3NH2(CH2)2NH2CH3][M2(HCOO)6] (M = MnII and CoII): weak ferromagnetic metal formate frameworks of unique binodal 6-connected (4(12).6(3))(4(9).6(6)) topology, templated by a diammonium cation. Inorganic chemistry 46(21) (2007) 8439-8441
Space group: P -3 1 c
Cell volume: 902.61
Cell parameters: 8.3176; 8.3176; 15.0651; 90; 90; 120;

COD ID: 4339602

Formula: - C10 H20 Co2 N2 O12 -
Comments: Wang, Zheming; Zhang, Xueyu; Batten, Stuart R.; Kurmoo, Mohamedally; Gao, Song [CH3NH2(CH2)2NH2CH3][M2(HCOO)6] (M = MnII and CoII): weak ferromagnetic metal formate frameworks of unique binodal 6-connected (4(12).6(3))(4(9).6(6)) topology, templated by a diammonium cation. Inorganic chemistry 46(21) (2007) 8439-8441
Space group: P -3 1 c
Cell volume: 850.77
Cell parameters: 8.1805; 8.1805; 14.6798; 90; 90; 120;

COD ID: 4340581

Formula: - C60 H60 Fe2 K4 N30 O12 Zn -
Comments: Park, Ka Hyun; Lee, Kang Mun; Go, Min Jeong; Choi, Sung Ho; Park, Hyoung-Ryun; Kim, Youngjo; Lee, Junseong New Class of Scorpionate: Tris(tetrazolyl)-Iron Complex and Its Different Coordination Modes for Alkali Metal Ions. Inorganic chemistry 53(16) (2014) 8213-8220
Space group: P -3 1 c
Cell volume: 4592.5
Cell parameters: 15.4612; 15.4612; 22.1834; 90; 90; 120;

COD ID: 4342763

Formula: - C48 H66 Fe2 N6 Ni O13 -
Comments: Sotnik, Svetlana A.; Polunin, Ruslan A.; Kiskin, Mikhail A.; Kirillov, Alexander M.; Dorofeeva, Victoria N.; Gavrilenko, Konstantin S.; Eremenko, Igor L.; Novotortsev, Vladimir M.; Kolotilov, Sergey V. Heterometallic Coordination Polymers Assembled from Trigonal Trinuclear Fe2Ni-Pivalate Blocks and Polypyridine Spacers: Topological Diversity, Sorption, and Catalytic Properties. Inorganic chemistry 54(11) (2015) 5169-5181
Space group: P -3 1 c
Cell volume: 3600.4
Cell parameters: 16.667; 16.667; 14.966; 90; 90; 120;

COD ID: 4344283
CIF file	Formula: - Cl18 Cs Fe La Zr6 - Comments: Zhang, J.; Corbett, J.D. Two families of centered zirconium cluster phases with M1,2 M' Cl6 * Zr6 Cl12 Z compositions Inorganic Chemistry 32 (1993) 1556-1572 Space group: P -3 1 c Cell volume: 1475.47 Cell parameters: 9.6404; 9.6404; 18.332; 90; 90; 120;

COD ID: 4344438
CIF file	Formula: - C72 H84 Mn N6 O16 U2 - Comments: Thuéry, Pierre; Harrowfield, Jack A New Form of Triple-Stranded Helicate Found in Uranyl Complexes of Aliphatic α,ω-Dicarboxylates. Inorganic chemistry 54(22) (2015) 10539-10541 Space group: P -3 1 c Cell volume: 3514.52 Cell parameters: 13.4661; 13.4661; 22.3796; 90; 90; 120;

COD ID: 4344439
CIF file	Formula: - C72 H84 Co N6 O16 U2 - Comments: Thuéry, Pierre; Harrowfield, Jack A New Form of Triple-Stranded Helicate Found in Uranyl Complexes of Aliphatic α,ω-Dicarboxylates. Inorganic chemistry 54(22) (2015) 10539-10541 Space group: P -3 1 c Cell volume: 3467.21 Cell parameters: 13.4057; 13.4057; 22.2777; 90; 90; 120;

COD ID: 4345098

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 824.048
Cell parameters: 8.2755; 8.2755; 13.8942; 90; 90; 120;

COD ID: 4345099

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.013
Cell parameters: 8.2127; 8.2127; 13.6789; 90; 90; 120;

COD ID: 4345100

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 821.365
Cell parameters: 8.2674; 8.2674; 13.8761; 90; 90; 120;

COD ID: 4345101

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 823.604
Cell parameters: 8.2744; 8.2744; 13.8904; 90; 90; 120;

COD ID: 4345102

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.929
Cell parameters: 8.2184; 8.2184; 13.6756; 90; 90; 120;

COD ID: 4345103

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.591
Cell parameters: 8.2163; 8.2163; 13.6768; 90; 90; 120;

COD ID: 4345104

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 800.041
Cell parameters: 8.2136; 8.2136; 13.6935; 90; 90; 120;

COD ID: 4345105

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.628
Cell parameters: 8.2158; 8.2158; 13.6791; 90; 90; 120;

COD ID: 4345106

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 823.14
Cell parameters: 8.2726; 8.2726; 13.8886; 90; 90; 120;

COD ID: 4345107

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.542
Cell parameters: 8.2132; 8.2132; 13.6863; 90; 90; 120;

COD ID: 4345108

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.764
Cell parameters: 8.2165; 8.2165; 13.6791; 90; 90; 120;

COD ID: 4345109

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 822.95
Cell parameters: 8.2722; 8.2722; 13.8867; 90; 90; 120;

COD ID: 4345110

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 824.019
Cell parameters: 8.2761; 8.2761; 13.8917; 90; 90; 120;

COD ID: 4345111

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 824.383
Cell parameters: 8.2762; 8.2762; 13.8975; 90; 90; 120;

COD ID: 4345112

Formula: - C8 H14 Fe Mn N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 824.552
Cell parameters: 8.2777; 8.2777; 13.8953; 90; 90; 120;

COD ID: 4345113

Formula: - C8 H14 Co Fe N O12 -
Comments: Mazzuca, Lidia; Cañadillas-Delgado, Laura; Rodríguez-Velamazán, J Alberto; Fabelo, Oscar; Scarrozza, Marco; Stroppa, Alessandro; Picozzi, Silvia; Zhao, Jiong-Peng; Bu, Xian-He; Rodríguez-Carvajal, Juan Magnetic Structures of Heterometallic M(II)-M(III) Formate Compounds. Inorganic chemistry 56(1) (2017) 197-207
Space group: P -3 1 c
Cell volume: 799.71
Cell parameters: 8.2114; 8.2114; 13.6951; 90; 90; 120;

COD ID: 4345523
CIF file	Formula: - Hg2.83 K Mo12 S14 - Comments: Gougeon, Patrick; Gall, Philippe Synthesis, Structure, and Electrical Properties of the Mo12 Cluster Sulfide Hg∼2.8KMo12S14 Containing Mercury Chains. Inorganic chemistry 56(6) (2017) 3440-3446 Space group: P -3 1 c Cell volume: 1206.76 Cell parameters: 9.2374; 9.2374; 16.3302; 90; 90; 120;

COD ID: 4346148

Formula: - C30 H54 B2 F8 N6 Ni S6 -
Comments: Mogesa, Benjamin; Perera, Eranda; Rhoda, Hannah M.; Gibson, John K.; Oomens, Jos; Berden, Giel; van Stipdonk, Michael J.; Nemykin, Victor N.; Basu, Partha Solution, Solid, and Gas Phase Studies on a Nickel Dithiolene System: Spectator Metal and Reactor Ligand. Inorganic chemistry 54(16) (2015) 7703-7716
Space group: P -3 1 c
Cell volume: 2338.7
Cell parameters: 15.0044; 15.0044; 11.995; 90; 90; 120;

COD ID: 4348346

Formula: - C72 H64 Cd5 Cl10 N6 O20 -
Comments: Leroux, Maxime; Mercier, Nicolas; Allain, Magali; Dul, Marie-Claire; Dittmer, Jens; Kassiba, Abdel Hadi; Bellat, Jean-Pierre; Weber, Guy; Bezverkhyy, Igor Porous Coordination Polymer Based on Bipyridinium Carboxylate Linkers with High and Reversible Ammonia Uptake. Inorganic chemistry 55(17) (2016) 8587-8594
Space group: P -3 1 c
Cell volume: 4337
Cell parameters: 18.196; 18.196; 15.127; 90; 90; 120;

COD ID: 4350580
CIF file	Formula: - C12 H18 Cl Cu0.67 N3.67 O4 - Comments: Ravikumar, I.; Suresh, E.; Ghosh, Pradyut A perfect linear Cu-NNN-Cu unit inside the cryptand cavity and perchlorate entrapment within the channel formed by the cascade complex. Inorganic chemistry 45(25) (2006) 10046-10048 Space group: P -3 1 c Cell volume: 2137.3 Cell parameters: 9.7683; 9.7683; 25.864; 90; 90; 120;

COD ID: 4502529

Formula: - C17 H15.66 N18.67 Na O1.66 Zn -
Comments: Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design 10(7) (2010) 2908
Space group: P -3 1 c
Cell volume: 1329.8
Cell parameters: 10.4655; 10.4655; 14.02; 90; 90; 120;

COD ID: 4502530

Formula: - C18 H17 Cd N19 Na O1.5 -
Comments: Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design 10(7) (2010) 2908
Space group: P -3 1 c
Cell volume: 1377.36
Cell parameters: 10.8014; 10.8014; 13.6319; 90; 90; 120;

COD ID: 4502531

Formula: - C18 H16 Mn N19 Na O -
Comments: Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design 10(7) (2010) 2908
Space group: P -3 1 c
Cell volume: 1352.5
Cell parameters: 10.64; 10.64; 13.795; 90; 90; 120;

COD ID: 4502532

Formula: - C18 H16 Co N19 Na O -
Comments: Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design 10(7) (2010) 2908
Space group: P -3 1 c
Cell volume: 1316.2
Cell parameters: 10.4089; 10.4089; 14.028; 90; 90; 120;

COD ID: 4502533

Formula: - C18 H17 N19 Na Ni O1.5 -
Comments: Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design 10(7) (2010) 2908
Space group: P -3 1 c
Cell volume: 1298.73
Cell parameters: 10.3189; 10.3189; 14.0839; 90; 90; 120;

COD ID: 4502885

Formula: - C48 H30 O16 Zn3 -
Comments: Gao, Qian; Xie, Ya-Bo; Li, Jian-Rong; Yuan, Da-Qiang; Yakovenko, Audrey A.; Sun, Ji-Hong; Zhou, Hong-Cai Tuning the Formations of Metal‒Organic Frameworks by Modification of Ratio of Reactant, Acidity of Reaction System, and Use of a Secondary Ligand Crystal Growth & Design 12(1) (2012) 281
Space group: P -3 1 c
Cell volume: 3472.1
Cell parameters: 15.578; 15.578; 16.521; 90; 90; 120;

COD ID: 4506200

Formula: - C63 H39 Cl Co2 N12 O6 -
Comments: Agarwal, Rashmi A.; Aijaz, Arshad; Ahmad, Musheer; Sañudo, E. Carolina; Xu, Qiang; Bharadwaj, Parimal K. Two New Coordination Polymers with Co(II) and Mn(II): Selective Gas Adsorption and Magnetic Studies Crystal Growth & Design 12(6) (2012) 2999
Space group: P -3 1 c
Cell volume: 3497.1
Cell parameters: 17.031; 17.031; 13.922; 90; 90; 120;

COD ID: 4507158

Formula: - C18 H28 Cd5 N36 O -
Comments: Tseng, Tien-Wen; Luo, Tzuoo-Tsair; Chen, She-Yu; Su, Chong-Cheng; Chi, Kai-Ming; Lu, Kuang-Lieh Porous Metal‒Organic Frameworks with Multiple Cages Based on Tetrazolate Ligands: Synthesis, Structures, Photoluminescence, and Gas Adsorption Properties Crystal Growth & Design 13(2) (2013) 510
Space group: P -3 1 c
Cell volume: 2027.4
Cell parameters: 13.0959; 13.0959; 13.65; 90; 90; 120;

COD ID: 4507488

Formula: - C48 H24 N6 O23 Zn3 -
Comments: Han, Liqin; Yan, Yan; Sun, Fuxing; Cai, Kun; Borjigin, Tsolmon; Zhao, Xiaojun; Qu, Fengyu; Zhu, Guangshan Single- and Double-Layer Structures and Sorption Properties of Two Microporous Metal‒Organic Frameworks with Flexible Tritopic Ligand Crystal Growth & Design 13(4) (2013) 1458
Space group: P -3 1 c
Cell volume: 3334.25
Cell parameters: 16.5254; 16.5254; 14.0982; 90; 90; 120;

COD ID: 4507515
CIF file	Formula: - C63 H39 Cl N12 Ni2 O6 - Comments: Agarwal, Rashmi A.; Aijaz, Arshad; Sañudo, Carolina; Xu, Qiang; Bharadwaj, Parimal K. Gas Adsorption and Magnetic Properties in Isostructural Ni(II), Mn(II), and Co(II) Coordination Polymers Crystal Growth & Design 13(3) (2013) 1238 Space group: P -3 1 c Cell volume: 3446.7 Cell parameters: 16.954; 16.954; 13.846; 90; 90; 120;

COD ID: 4507516
CIF file	Formula: - C63 H39 Cl Mn2 N12 O6 - Comments: Agarwal, Rashmi A.; Aijaz, Arshad; Sañudo, Carolina; Xu, Qiang; Bharadwaj, Parimal K. Gas Adsorption and Magnetic Properties in Isostructural Ni(II), Mn(II), and Co(II) Coordination Polymers Crystal Growth & Design 13(3) (2013) 1238 Space group: P -3 1 c Cell volume: 3645.9 Cell parameters: 17.275; 17.275; 14.107; 90; 90; 120;

COD ID: 4508053
CIF file	Formula: - C12 H8.58 O3.33 Zn0.5 - Comments: Chaudhari, Abhijeet K.; Nagarkar, Sanjog S.; Joarder, Biplab; Ghosh, Sujit K. A Continuous π-Stacked Starfish Array of Two-Dimensional Luminescent MOF for Detection of Nitro Explosives Crystal Growth & Design 13(8) (2013) 3716 Space group: P -3 1 c Cell volume: 3453.7 Cell parameters: 16.6972; 16.6972; 14.3042; 90; 90; 120;

COD ID: 4508054
CIF file	Formula: - C9 H5.67 O3.33 Zn0.5 - Comments: Chaudhari, Abhijeet K.; Nagarkar, Sanjog S.; Joarder, Biplab; Ghosh, Sujit K. A Continuous π-Stacked Starfish Array of Two-Dimensional Luminescent MOF for Detection of Nitro Explosives Crystal Growth & Design 13(8) (2013) 3716 Space group: P -3 1 c Cell volume: 3453.7 Cell parameters: 16.6972; 16.6972; 14.3042; 90; 90; 120;

COD ID: 4508224
CIF file	Formula: - C33 H33 Co2 N3 O19 Ti - Comments: Hong, Keunil; Bak, Woojeong; Moon, Dohyun; Chun, Hyungphil Bistable and Porous Metal‒Organic Frameworks with Charge-NeutralacsNet Based on Heterometallic M3O(CO2)6Building Blocks Crystal Growth & Design 13(9) (2013) 4066 Space group: P -3 1 c Cell volume: 3489.9 Cell parameters: 15.772; 15.772; 16.2; 90; 90; 120;

COD ID: 4510167

Formula: - C24 H26 B18 Co Cu2 O10 -
Comments: Kennedy, Robert D.; Clingerman, Daniel J.; Morris, William; Wilmer, Christopher E.; Sarjeant, Amy A.; Stern, Charlotte L.; O’Keeffe, Michael; Snurr, Randall Q.; Hupp, Joseph T.; Farha, Omar K.; Mirkin, Chad A. Metallacarborane-Based Metal‒Organic Framework with a Complex Topology Crystal Growth & Design 14(3) (2014) 1324
Space group: P -3 1 c
Cell volume: 13586
Cell parameters: 18.248; 18.248; 47.113; 90; 90; 120;

COD ID: 4511740

Formula: - C86 H101 Li11 O58 -
Comments: Aliev, Sokhrab B.; Samsonenko, Denis G.; Rakhmanova, Mariana I.; Dybtsev, Danil N.; Fedin, Vladimir P. Syntheses and Structural Characterization of Lithium Carboxylate Frameworks and Guest-Dependent Photoluminescence Study Crystal Growth & Design 14(9) (2014) 4355
Space group: P -3 1 c
Cell volume: 5811.2
Cell parameters: 18.6108; 18.6108; 19.3734; 90; 90; 120;

COD ID: 4512038
CIF file	Formula: - C63 H39 B F4 N12 Ni2 O6 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3390.2 Cell parameters: 16.774; 16.774; 13.913; 90; 90; 120;

COD ID: 4512039
CIF file	Formula: - C63 H39 Cl N12 Ni2 O10 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3413 Cell parameters: 16.802; 16.802; 13.96; 90; 90; 120;

COD ID: 4512040
CIF file	Formula: - C63 H39 N13 Ni2 O9 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3422.5 Cell parameters: 16.87; 16.87; 13.886; 90; 90; 120;

COD ID: 4512041
CIF file	Formula: - C63 H39 Cl N12 Ni2 O6 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3441.4 Cell parameters: 16.946; 16.946; 13.838; 90; 90; 120;

COD ID: 4512042
CIF file	Formula: - C63 H39 Cl Co2 N12 O10 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3483.5 Cell parameters: 16.901; 16.901; 14.082; 90; 90; 120;

COD ID: 4512043
CIF file	Formula: - C63 H39 Co2 N13 O9 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3493.2 Cell parameters: 17.03; 17.03; 13.908; 90; 90; 120;

COD ID: 4512044
CIF file	Formula: - C63 H39 Cl Co2 N12 O6 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3513 Cell parameters: 17.088; 17.088; 13.892; 90; 90; 120;

COD ID: 4512046
CIF file	Formula: - C72 H57 Cl Co2 N12 O16 - Comments: Agarwal, Rashmi A.; Bharadwaj, Parimal K. Guest Exchange Reactions in Isostructural 3D Porous Coordination Polymers of Ni(II), Co(II), and Mn(II) Crystal Growth & Design 14(11) (2014) 6115 Space group: P -3 1 c Cell volume: 3472.9 Cell parameters: 16.975; 16.975; 13.917; 90; 90; 120;

COD ID: 4512220

Formula: - C63 H39 Cl Mn2 N12 O10 -
Comments: Agarwal, Rashmi A.; Mukherjee, Soumya; Sañudo, E. Carolina; Ghosh, Sujit K.; Bharadwaj, Parimal K. Gas Adsorption, Magnetism, and Single-Crystal to Single-Crystal Transformation Studies of a Three-Dimensional Mn(II) Porous Coordination Polymer Crystal Growth & Design 14(11) (2014) 5585
Space group: P -3 1 c
Cell volume: 3582
Cell parameters: 17.107; 17.107; 14.133; 90; 90; 120;

COD ID: 4512221

Formula: - C63 H39 Cl Mn2 N12 O6 -
Comments: Agarwal, Rashmi A.; Mukherjee, Soumya; Sañudo, E. Carolina; Ghosh, Sujit K.; Bharadwaj, Parimal K. Gas Adsorption, Magnetism, and Single-Crystal to Single-Crystal Transformation Studies of a Three-Dimensional Mn(II) Porous Coordination Polymer Crystal Growth & Design 14(11) (2014) 5585
Space group: P -3 1 c
Cell volume: 3641
Cell parameters: 17.246; 17.246; 14.135; 90; 90; 120;

COD ID: 4512222

Formula: - C63 H39 Mn2 N13 O9 -
Comments: Agarwal, Rashmi A.; Mukherjee, Soumya; Sañudo, E. Carolina; Ghosh, Sujit K.; Bharadwaj, Parimal K. Gas Adsorption, Magnetism, and Single-Crystal to Single-Crystal Transformation Studies of a Three-Dimensional Mn(II) Porous Coordination Polymer Crystal Growth & Design 14(11) (2014) 5585
Space group: P -3 1 c
Cell volume: 3712
Cell parameters: 17.485; 17.485; 14.019; 90; 90; 120;

COD ID: 4512223

Formula: - C72 H57 Mn2 N13 O15 -
Comments: Agarwal, Rashmi A.; Mukherjee, Soumya; Sañudo, E. Carolina; Ghosh, Sujit K.; Bharadwaj, Parimal K. Gas Adsorption, Magnetism, and Single-Crystal to Single-Crystal Transformation Studies of a Three-Dimensional Mn(II) Porous Coordination Polymer Crystal Growth & Design 14(11) (2014) 5585
Space group: P -3 1 c
Cell volume: 3600
Cell parameters: 17.203; 17.203; 14.045; 90; 90; 120;

COD ID: 7000436
CIF file	Formula: - C40 H116 Mn15 N0 O78 P4 - Comments: Wang, Mei; Ma, Chengbing; Wen, Huimin; Chen, Changneng Synthesis and characterization of a series of manganese phosphonate complexes with various valences and nuclearity Dalton Transactions (issue 6) (2009) 994-1003 Space group: P -3 1 c Cell volume: 5075 Cell parameters: 16.702; 16.702; 21.008; 90; 90; 120;

COD ID: 7006333

Formula: - C114 H132 N6 Na6 -
Comments: Avent, Anthony G.; Antolini, Floria; Hitchcock, Peter B.; Khvostov, Alexei V.; Lappert, Michael F.; Protchenko, Andrey V. Reactions between a sodium amide Na[N(SiMe3)R1] (R1 = SiMe3, SiMe2Ph or But) and a cyanoalkane RCN (R = Ad or Bu(t)). Dalton transactions (Cambridge, England : 2003) (issue 7) (2006) 919-927
Space group: P -3 1 c
Cell volume: 5147.4
Cell parameters: 15.9031; 15.9031; 23.5014; 90; 90; 120;

COD ID: 7010778

Formula: - C113 H228 O36.5 P21 Pd59 -
Comments: Tran, Nguyet T.; Kawano, Masaki; Dahl, Lawrence F. High-nuclearity palladium carbonyl trimethylphosphine clusters containing unprecedented face-condensed icosahedral-based transition-metal core geometries: proposed growth patterns from a centered Pd13 icosahedron† Journal of the Chemical Society, Dalton Transactions (issue 19) (2001) 2731
Space group: P -3 1 c
Cell volume: 12601.3
Cell parameters: 22.7815; 22.7815; 28.0363; 90; 90; 120;

COD ID: 7011812

Formula: - C36 H180 Ni9 O S18 -
Comments: Ivanov, Sergei A.; Kozee, Michael A.; Alex Merrill, W.; Agarwal, Sorabh; Dahl, Lawrence F. Cyclo-[Ni(μ~2~-SPh)~2~]~9~ and cyclo-[Ni(μ~2~-SPh)~2~]~11~: new oligomeric types of toroidal nickel(ii) thiolates containing geometrically unprecedented 9- and 11-membered ring systems Journal of the Chemical Society, Dalton Transactions (issue 22) (2002) 4105-4115
Space group: P -3 1 c
Cell volume: 5941.2
Cell parameters: 18.0237; 18.0237; 21.1181; 90; 90; 120;

COD ID: 7014096

Formula: - C39 H51 B Co F9 N6.5 P2.5 S3 -
Comments: Mihalcik, David J.; White, Jennifer L.; Tanski, Joseph M.; Zakharov, Lev N.; Yap, Glenn P. A.; Incarvito, Christopher D.; Rheingold, Arnold L.; Rabinovich, Daniel Cobalt tris(mercaptoimidazolyl)borate complexes: synthetic studies and the structure of the first cobaltaboratrane. Dalton transactions (Cambridge, England : 2003) (issue 10) (2004) 1626-1634
Space group: P -3 1 c
Cell volume: 5092.3
Cell parameters: 11.46; 11.46; 44.773; 90; 90; 120;

COD ID: 7015324

Formula: - C31 H73.5 N16 Ni5.25 O39 -
Comments: Tandon, Santokh S.; Dul, Marie-Claire; Lee, John L.; Dawe, Louise N.; Anwar, Muhammad U.; Thompson, Laurence K. Complexes of ditopic carbo- and thio-carbohydrazone ligands‒mononuclear, 1D chain, dinuclear and tetranuclear examples. Dalton transactions (Cambridge, England : 2003) 40(14) (2011) 3466-3475
Space group: P -3 1 c
Cell volume: 21100.6
Cell parameters: 28.4916; 28.4916; 30.0145; 90; 90; 120;

COD ID: 7015399

Formula: - C48 H58 N14 O20 Zn -
Comments: Wu, Biao; Yang, Jin; Huang, Xiaojuan; Li, Shaoguang; Jia, Chuandong; Yang, Xiao-Juan; Tang, Ning; Janiak, Christoph Anion binding by metallo-receptors of 5,5'-dicarbamate-2,2'-bipyridine ligands. Dalton transactions (Cambridge, England : 2003) 40(21) (2011) 5687-5696
Space group: P -3 1 c
Cell volume: 2925.8
Cell parameters: 13.499; 13.499; 18.54; 90; 90; 120;

COD ID: 7019901

Formula: - C42 H30 Cu6 N24 S6 -
Comments: Shan, Xiao-Chen; Jiang, Fei-Long; Yuan, Da-Qiang; Wu, Ming-Yan; Zhang, Shu-Quan; Hong, Mao-Chun The unusual thermochromic NIR luminescence of Cu(i) clusters: tuned by Cu-Cu interactions and packing modes. Dalton transactions (Cambridge, England : 2003) 41(31) (2012) 9411-9416
Space group: P -3 1 c
Cell volume: 5934.1
Cell parameters: 19.7989; 19.7989; 17.4799; 90; 90; 120;

COD ID: 7020487

Formula: - C7 H9 Cl0.33 N O1.5 Ru0.17 -
Comments: Fuentes, Michelle J.; Bognanno, Richard J.; Dougherty, William G.; Boyko, Walter J.; Kassel, W. Scott; Dudley, Timothy J.; Paul, Jared J. Structural, electronic and acid/base properties of [Ru(bpy(OH)2)3]2+ (bpy(OH)2 = 4,4'-dihydroxy-2,2'-bipyridine). Dalton transactions (Cambridge, England : 2003) 41(40) (2012) 12514-12523
Space group: P -3 1 c
Cell volume: 2290.3
Cell parameters: 12.7647; 12.7647; 16.2308; 90; 90; 120;

COD ID: 7021526

Formula: - C54 H34 N0 O20 Zn3 -
Comments: Phang, Won Ju; Lee, Woo Ram; Yoo, Kicheon; Kim, Bongsoo; Hong, Chang Seop Selective CO2 adsorption and proton conductivity in the two-dimensional Zn(ii) framework with protruded water molecules and flexible ether linkers. Dalton transactions (Cambridge, England : 2003) 42(22) (2013) 7850-7853
Space group: P -3 1 c
Cell volume: 3489.15
Cell parameters: 16.7421; 16.7421; 14.3737; 90; 90; 120;

COD ID: 7021698

Formula: - C87 H72 Cl3 Cu3 N12 O12 -
Comments: Lemus, Luis; Guerrero, Juan; Costamagna, Juan; Lorca, Romina; Jara, Danilo H.; Ferraudi, Guillermo; Oliver, Allen; Lappin, A. Graham Resolution and characterization of helicate dimer and trimer complexes of 1,3-bis(9-methyl-1,10-phenanthrolin-2-yl)propane with copper(i). Dalton transactions (Cambridge, England : 2003) 42(32) (2013) 11426-11435
Space group: P -3 1 c
Cell volume: 4403.7
Cell parameters: 16.97; 16.97; 17.6573; 90; 90; 120;

COD ID: 7021898

Formula: - C6 H5 N4 O2 Zn -
Comments: Luo, Ming-Biao; Yuan, Zi-Zun; Xu, Wen-Yuan; Luo, Feng; Li, Jian-Qiang; Zhu, Yan; Feng, Xue-Feng; Liu, Shu-Juan Framework isomers controlled by the speed of crystallization: different aggregation fashions of Zn(ii) and 1,2,4-triazol-3-amine, distinct (3,4)-connected self-penetrating nets, and various pore shapes. Dalton transactions (Cambridge, England : 2003) 42(38) (2013) 13802-13805
Space group: P -3 1 c
Cell volume: 3112.8
Cell parameters: 11.8739; 11.8739; 25.494; 90; 90; 120;

COD ID: 7023767

Formula: - C18 H26 B2 N18 Na2 S6 -
Comments: Imran, Muhammad; Neumann, Beate; Stammler, Hans-Georg; Monkowius, Uwe; Ertl, Martin; Mitzel, Norbert W. The versatile behaviour of a novel Janus scorpionate ligand towards sodium, potassium and bismuth(iii) ions. Dalton transactions (Cambridge, England : 2003) 42(44) (2013) 15785-15795
Space group: P -3 1 c
Cell volume: 2026.78
Cell parameters: 13.1216; 13.1216; 13.5926; 90; 90; 120;

COD ID: 7023769

Formula: - C18 H26 B2 K N18 Na S6 -
Comments: Imran, Muhammad; Neumann, Beate; Stammler, Hans-Georg; Monkowius, Uwe; Ertl, Martin; Mitzel, Norbert W. The versatile behaviour of a novel Janus scorpionate ligand towards sodium, potassium and bismuth(iii) ions. Dalton transactions (Cambridge, England : 2003) 42(44) (2013) 15785-15795
Space group: P -3 1 c
Cell volume: 2068.7
Cell parameters: 13.0298; 13.0298; 14.0697; 90; 90; 120;

COD ID: 7025397

Formula: - C42 H52 Cl Fe3 N12 O21 -
Comments: Miao, Yan-Li; Liu, Jun-Liang; Lin, Zhuo-Jia; Ou, Yong-Cong; Leng, Ji-Dong; Tong, Ming-Liang Synthesis, structures, adsorption behaviour and magnetic properties of a new family of polynuclear iron clusters. Dalton transactions (Cambridge, England : 2003) 39(20) (2010) 4893-4902
Space group: P -3 1 c
Cell volume: 2892.6
Cell parameters: 18.9538; 18.9538; 9.2975; 90; 90; 120;

COD ID: 7025398

Formula: - C42 H52 Br Fe3 N12 O21 -
Comments: Miao, Yan-Li; Liu, Jun-Liang; Lin, Zhuo-Jia; Ou, Yong-Cong; Leng, Ji-Dong; Tong, Ming-Liang Synthesis, structures, adsorption behaviour and magnetic properties of a new family of polynuclear iron clusters. Dalton transactions (Cambridge, England : 2003) 39(20) (2010) 4893-4902
Space group: P -3 1 c
Cell volume: 2984
Cell parameters: 19.104; 19.104; 9.4409; 90; 90; 120;

COD ID: 7028538
CIF file	Formula: - C2 H2 Ag Br0 K N2 O - Comments: Liu, Xi; Li, Lin; Yang, Yun-Zhi; Huang, Kun-Lin Doping potassium ions in silver cyanide complexes for green luminescence. Dalton transactions (Cambridge, England : 2003) 43(10) (2014) 4086-4092 Space group: P -3 1 c Cell volume: 835.06 Cell parameters: 7.3932; 7.3932; 17.641; 90; 90; 120;

COD ID: 7029146
CIF file	Formula: - C54 H30 O26 Zn3 - Comments: He, Hongming; Sun, Fuxing; Borjigin, Tsolmon; Zhao, Nian; Zhu, Guangshan Tunable colors and white-light emission based on a microporous luminescent Zn(ii)-MOF. Dalton transactions (Cambridge, England : 2003) 43(9) (2014) 3716-3721 Space group: P -3 1 c Cell volume: 3486.4 Cell parameters: 16.6504; 16.6504; 14.521; 90; 90; 120;

COD ID: 7033239

Formula: - C3 H4.33 Cl0.33 Cu1.67 N12 O1.33 -
Comments: Hou, Zhao-Jun; Liu, Zhong-Yi; Liu, Ning; Yang, En-Cui; Zhao, Xiao-Jun Four tetrazolate-based 3D frameworks with diverse subunits directed by inorganic anions and azido coligand: hydro/solvothermal syntheses, crystal structures, and magnetic properties. Dalton transactions (Cambridge, England : 2003) 44(5) (2015) 2223-2233
Space group: P -3 1 c
Cell volume: 1650.56
Cell parameters: 12.3275; 12.3275; 12.5415; 90; 90; 120;

COD ID: 7033911

Formula: - C42 H85 Cu8 F6 N6 P Se12 -
Comments: Dhayal, Rajendra S.; Liao, Jian-Hong; Hou, Hsing-Nan; Ervilita, Ria; Liao, Ping-Kuei; Liu, C. W. Copper(i) diselenocarbamate clusters: synthesis, structures and single-source precursors for Cu and Se composite materials. Dalton transactions (Cambridge, England : 2003) 44(12) (2015) 5898-5908
Space group: P -3 1 c
Cell volume: 3860
Cell parameters: 15.5076; 15.5076; 18.534; 90; 90; 120;

COD ID: 7034429

Formula: - C8 H14 Fe Mg N O12 -
Comments: Ciupa, Aneta; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Trzmiel, Justyna; Pikul, Adam; Ptak, Maciej Temperature-dependent studies of [(CH3)2NH2][Fe(III)M(II)(HCOO)6] frameworks (M(II) = Fe and Mg): structural, magnetic, dielectric and phonon properties. Dalton transactions (Cambridge, England : 2003) 44(19) (2015) 8846-8854
Space group: P -3 1 c
Cell volume: 807.64
Cell parameters: 8.2008; 8.2008; 13.8667; 90; 90; 120;

COD ID: 7034430

Formula: - C8 H14 Fe Mg N O12 -
Comments: Ciupa, Aneta; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Trzmiel, Justyna; Pikul, Adam; Ptak, Maciej Temperature-dependent studies of [(CH3)2NH2][Fe(III)M(II)(HCOO)6] frameworks (M(II) = Fe and Mg): structural, magnetic, dielectric and phonon properties. Dalton transactions (Cambridge, England : 2003) 44(19) (2015) 8846-8854
Space group: P -3 1 c
Cell volume: 809.68
Cell parameters: 8.2067; 8.2067; 13.8818; 90; 90; 120;

COD ID: 7034431

Formula: - C8 H14 Fe Mg N O12 -
Comments: Ciupa, Aneta; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Trzmiel, Justyna; Pikul, Adam; Ptak, Maciej Temperature-dependent studies of [(CH3)2NH2][Fe(III)M(II)(HCOO)6] frameworks (M(II) = Fe and Mg): structural, magnetic, dielectric and phonon properties. Dalton transactions (Cambridge, England : 2003) 44(19) (2015) 8846-8854
Space group: P -3 1 c
Cell volume: 810.85
Cell parameters: 8.2076; 8.2076; 13.8988; 90; 90; 120;

COD ID: 7035406

Formula: - C8 H14 Fe N Ni O12 -
Comments: Ciupa, Aneta; Mączka, Mirosław; Gągor, Anna; Pikul, Adam; Ptak, Maciej Synthesis and characterization of novel niccolites [(CH3)2NH2][Fe(III)M(II)(HCOO)6] (M(II) = Zn, Ni, Cu). Dalton transactions (Cambridge, England : 2003) 44(29) (2015) 13234-13241
Space group: P -3 1 c
Cell volume: 792.17
Cell parameters: 8.1856; 8.1856; 13.6517; 90; 90; 120;

COD ID: 7040588

Formula: - C449 H366 Fe27 N73 O147 S18 -
Comments: Das, Biswanath; Lee, Bao-Lin; Karlsson, Erik A.; Åkermark, Torbjörn; Shatskiy, Andrey; Demeshko, Serhiy; Liao, Rong-Zhen; Laine, Tanja M.; Haukka, Matti; Zeglio, Erica; Abdel-Magied, Ahmed F; Siegbahn, Per E. M.; Meyer, Franc; Kärkäs, Markus D; Johnston, Eric V.; Nordlander, Ebbe; Åkermark, Björn Water oxidation catalyzed by molecular di- and nonanuclear Fe complexes: importance of a proper ligand framework. Dalton transactions (Cambridge, England : 2003) 45(34) (2016) 13289-13293
Space group: P -3 1 c
Cell volume: 29912.7
Cell parameters: 27.7653; 27.7653; 44.8044; 90; 90; 120;

COD ID: 7044949

Formula: - C27 H53 O14 P S Ti3 -
Comments: Fan, Xi; Narayanam, Nagaraju; Gao, Meiyan; Zhang, Lei; Zhang, Jian Ligand dependent assembly of trinuclear titanium-oxo units into coordination tetrahedra and capsules. Dalton transactions (Cambridge, England : 2003) 47(3) (2018) 663-665
Space group: P -3 1 c
Cell volume: 15370.1
Cell parameters: 18.9359; 18.9359; 49.4964; 90; 90; 120;

COD ID: 7048858

Formula: - C36 H54 Cl3 N9 O14 Zn2 -
Comments: Chattopadhyay, Taraknath; B S, Anju; Gupta, Shourya; S, Ananya; Bertke, Jeffery A.; Kundu, Subrata NOx- anion recognition by bimetallic cryptates: selectivity for nitrite over nitrate. Dalton transactions (Cambridge, England : 2003) 48(21) (2019) 7085-7089
Space group: P -3 1 c
Cell volume: 2166
Cell parameters: 9.758; 9.758; 26.267; 90; 90; 120;

COD ID: 7048859

Formula: - C36 H54 Cl3 Cu2 N9 O14 -
Comments: Chattopadhyay, Taraknath; B S, Anju; Gupta, Shourya; S, Ananya; Bertke, Jeffery A.; Kundu, Subrata NOx- anion recognition by bimetallic cryptates: selectivity for nitrite over nitrate. Dalton transactions (Cambridge, England : 2003) 48(21) (2019) 7085-7089
Space group: P -3 1 c
Cell volume: 2216
Cell parameters: 9.9795; 9.9795; 25.6934; 90; 90; 120;

COD ID: 7049027

Formula: - C87 H132 K12 N36 O61 Ti12 -
Comments: Passadis, Stamatis S.; Hadjithoma, Sofia; Kalampounias, Angelos G.; Tsipis, Athanassios C.; Sproules, Stephen; Miras, Haralampos N.; Keramidas, Anastasios D.; Kabanos, Themistoklis A. Synthesis, structural and physicochemical characterization of a new type Ti6-oxo cluster protected by a cyclic imide dioxime ligand. Dalton transactions (Cambridge, England : 2003) 48(17) (2019) 5551-5559
Space group: P -3 1 c
Cell volume: 4743
Cell parameters: 20.265; 20.265; 13.335; 90; 90; 120;

COD ID: 7062466

Formula: - C36 H63 Cl9 Co8 N36 O22 -
Comments: Mahmudov, Ibadulla; Gurbanov, Atash V.; Martins, Luísa M. D. R. S.; Abdullayev, Yusif; Sujayev, Afsun; Mahmudov, Kamran T.; Pombeiro, Armando J. L. Co(ii/iii), Ni(ii) and Cu(ii) complexes with a pyrazole-functionalized 1,3,5-triazopentadiene: synthesis, structure and application in the oxidation of styrene to benzaldehyde New Journal of Chemistry 47(22) (2023) 10826-10833
Space group: P -3 1 c
Cell volume: 4758.2
Cell parameters: 16.4531; 16.4531; 20.2962; 90; 90; 120;

COD ID: 7100879
CIF file	Formula: - C92 H68 Cu6 N18 O2 S7 - Comments: Duan Chun-Ying; Yan Bai; Dong-Bin Dang; Guang-Jie He; Qing-Jin Meng; Yong-Gang Zhao Porous Material for Aborption and Luminescent Detection of Aromatic Molecules in Water Chemical Communications (2006) Space group: P -3 1 c Cell volume: 5839.8 Cell parameters: 19.861; 19.861; 17.094; 90; 90; 120;

COD ID: 7103227

Formula: - C42 H68 B2 I In N12 S6 -
Comments: Yurkerwich, Kevin; Buccella, Daniela; Melnick, Jonathan G; Parkin, Gerard Monovalent indium in a sulfur-rich coordination environment: synthesis, structure and reactivity of tris(2-mercapto-1-tert-butylimidazolyl)hydroborato indium, [TmBut]In. Chemical communications (Cambridge, England) (issue 28) (2008) 3305-3307
Space group: P -3 1 c
Cell volume: 3166.3
Cell parameters: 11.8575; 11.8575; 26.003; 90; 90; 120;

COD ID: 7103563
CIF file	Formula: - C42 H42 I3 In O8 P2 - Comments: Chen, Fu; Ma, Guibin; Cavell, Ronald G; Terskikh, Victor V; Wasylishen, Roderick E Solid-state (115)In NMR study of indium coordination complexes. Chemical communications (Cambridge, England) (issue 45) (2008) 5933-5935 Space group: P -3 1 c Cell volume: 2252.53 Cell parameters: 12.9326; 12.9326; 15.5514; 90; 90; 120;

COD ID: 7104063
CIF file	Formula: - C72 H162 Li6 P8 Si6 - Comments: Lerner, Hans-Wolfram; Wagner, Matthias; Bolte, Michael A Novel Type of Phosphide: Synthesis and X-ray Crystal Structure Analysis of (tBu~3~Si)~3~P~4~Li~3~ Chemical Communications (Cambridge, United Kingdom) (issue 8) (2003) 990-991 Space group: P -3 1 c Cell volume: 4754.3 Cell parameters: 14.2685; 14.2685; 26.965; 90; 90; 120;

COD ID: 7104118
CIF file	Formula: - C90 H163 N27 O50 - Comments: Xu, Wen-Zhi; Sun, Junliang; Huang, Zhi-Tang; Zheng, Qi-Yu Molecular encapsulation of a discrete (H2O)32 cluster with S6 symmetry in an organic crystalline supermolecule. Chemical communications (Cambridge, England) 34(2) (2008) 171-173 Space group: P -3 1 c Cell volume: 6467.68 Cell parameters: 19.5542; 19.5542; 19.5316; 90; 90; 120;

COD ID: 7104603

Formula: - C48 H24 Ni3 O16 -
Comments: Ma, Shengqian; Simmons, Jason M; Yuan, Daqiang; Li, Jian-Rong; Weng, Wei; Liu, Di-Jia; Zhou, Hong-Cai A nanotubular metal-organic framework with permanent porosity: structure analysis and gas sorption studies. Chemical communications (Cambridge, England) 34(27) (2009) 4049-4051
Space group: P -3 1 c
Cell volume: 3427.18
Cell parameters: 15.551; 15.551; 16.364; 90; 90; 120;

COD ID: 7105241
CIF file	Formula: - C180 H182 Au6 Cl4 Fe2 N24 O21 P6 - Comments: Vicente, José; Gil-Rubio, Juan; Barquero, Natalia; Cámara, Verónica; Masciocchi, Norberto Self-assembly of looped triple-stranded helicates. Chemical communications (Cambridge, England) 46(7) (2010) 1053-1055 Space group: P -3 1 c Cell volume: 9134.9 Cell parameters: 19.444; 19.444; 27.9; 90; 90; 120;

COD ID: 7112168
CIF file	Formula: - C24 H6 O18 Ti2 - Comments: Junkuo Gao; Jianwei Miao; Pei-Zhou Li; Wen Yuan Teng; Ling Yang; Yanli Zhao; Bin Liu; Qichun Zhang A p-type Ti(IV)-based metal-organic framework with visible-light photo-response Chem.Commun. 50 (2014) 3786 Space group: P -3 1 c Cell volume: 2165.4 Cell parameters: 14.62; 14.62; 11.698; 90; 90; 120;

COD ID: 7112791

Formula: - C35 H34 I3 N3 O5 -
Comments: Rajput, Lalit; Chernyshev, Vladimir V.; Biradha, Kumar Assembling triple helical amide-to-amide hydrogen bonded columns of tris(4-halophenyl)benzene-1,3,5-tricarboxamides into porous materials via halogen...halogen interactions. Chemical communications (Cambridge, England) 46(35) (2010) 6530-6532
Space group: P -3 1 c
Cell volume: 3321.62
Cell parameters: 22.5852; 22.5852; 7.5192; 90; 90; 120;

COD ID: 7112889

Formula: - C57 H87 Gd Mn4 N2 O24 -
Comments: Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Murray, Keith S. Synthesis, structural and magnetic studies of an isostructural family of mixed 3d/4f tetranuclear 'star' clusters. Chemical communications (Cambridge, England) 46(41) (2010) 7787-7789
Space group: P -3 1 c
Cell volume: 3406.13
Cell parameters: 15.9802; 15.9802; 15.4016; 90; 90; 120;

COD ID: 7112890

Formula: - C57 H87 Dy Mn4 N2 O24 -
Comments: Chilton, Nicholas F.; Langley, Stuart K.; Moubaraki, Boujemaa; Murray, Keith S. Synthesis, structural and magnetic studies of an isostructural family of mixed 3d/4f tetranuclear 'star' clusters. Chemical communications (Cambridge, England) 46(41) (2010) 7787-7789
Space group: P -3 1 c
Cell volume: 3422.5
Cell parameters: 16.036; 16.036; 15.368; 90; 90; 120;

COD ID: 7113366

Formula: - C32 H24 O12 P4 Zr -
Comments: Marco Taddei; Ferdinando Costantino; Riccardo Vivani; Stefano Sabatini; Sang-Ho Lim; Seth M. Cohen The use of a rigid tritopic phosphonic ligand for the synthesis of a robust honeycomb-like layered zirconium phosphonate framework Chem.Commun. 50 (2014) 5737
Space group: P -3 1 c
Cell volume: 6485
Cell parameters: 16.3472; 16.3472; 28.0214; 90; 90; 120;

COD ID: 7116593

Formula: - C432 H360 B28 F112 N72 O0 Pd6 Zn8 -
Comments: Yang, Yang; Jia, Jian-Hua; Pei, Xiao-Li; Zheng, Hao; Nan, Zi-Ang; Wang, Quan-Ming Diastereoselective synthesis of O symmetric heterometallic cubic cages Chemical Communications (Cambridge, United Kingdom) 51(18) (2015) 3804-3807
Space group: P -3 1 c
Cell volume: 35808
Cell parameters: 31.0248; 31.0248; 42.9572; 90; 90; 120;

COD ID: 7116862

Formula: - C18 H11.33 Co O6.67 -
Comments: Min Chen; Hui Zhao; Chun-Sen Liu; Xi Wang; Heng-Zhen Shi; Miao Du Template-directed construction of conformational supramolecular isomers for bilayer porous metal-organic frameworks with distinct gas sorption behaviors Chem.Commun. 51 (2015) 6014
Space group: P -3 1 c
Cell volume: 3696.8
Cell parameters: 16.789; 16.789; 15.144; 90; 90; 120;

COD ID: 7116864

Formula: - C18 H11.33 Co O6.67 -
Comments: Min Chen; Hui Zhao; Chun-Sen Liu; Xi Wang; Heng-Zhen Shi; Miao Du Template-directed construction of conformational supramolecular isomers for bilayer porous metal-organic frameworks with distinct gas sorption behaviors Chem.Commun. 51 (2015) 6014
Space group: P -3 1 c
Cell volume: 3640.7
Cell parameters: 16.7639; 16.7639; 14.9592; 90; 90; 120;

COD ID: 7116865

Formula: - C18 H11.33 Co O6.67 -
Comments: Min Chen; Hui Zhao; Chun-Sen Liu; Xi Wang; Heng-Zhen Shi; Miao Du Template-directed construction of conformational supramolecular isomers for bilayer porous metal-organic frameworks with distinct gas sorption behaviors Chem.Commun. 51 (2015) 6014
Space group: P -3 1 c
Cell volume: 3628.6
Cell parameters: 16.7335; 16.7335; 14.9637; 90; 90; 120;

COD ID: 7117108
CIF file	Formula: - C8 H14 Cr Mn N O12 - Comments: Jiong-Peng Zhao; Song-De Han; Xue Jiang; Sui-Jun Liu; Ran Zhao; Ze Chang; Xian-He Bu A heterometallic strategy to achieve a large magnetocaloric effect in polymeric 3d complexes Chem.Commun. 51 (2015) 8288 Space group: P -3 1 c Cell volume: 825.4 Cell parameters: 8.2865; 8.2865; 13.88; 90; 90; 120;

COD ID: 7117109
CIF file	Formula: - C7 H12 Cr Mn N O12 - Comments: Jiong-Peng Zhao; Song-De Han; Xue Jiang; Sui-Jun Liu; Ran Zhao; Ze Chang; Xian-He Bu A heterometallic strategy to achieve a large magnetocaloric effect in polymeric 3d complexes Chem.Commun. 51 (2015) 8288 Space group: P -3 1 c Cell volume: 834.6 Cell parameters: 8.2708; 8.2708; 14.088; 90; 90; 120;

COD ID: 7117110
CIF file	Formula: - C8 H14 Al Mn N O12 - Comments: Jiong-Peng Zhao; Song-De Han; Xue Jiang; Sui-Jun Liu; Ran Zhao; Ze Chang; Xian-He Bu A heterometallic strategy to achieve a large magnetocaloric effect in polymeric 3d complexes Chem.Commun. 51 (2015) 8288 Space group: P -3 1 c Cell volume: 798.1 Cell parameters: 8.2179; 8.2179; 13.646; 90; 90; 120;

COD ID: 7117111
CIF file	Formula: - C8 H14 Cr Mg N O12 - Comments: Jiong-Peng Zhao; Song-De Han; Xue Jiang; Sui-Jun Liu; Ran Zhao; Ze Chang; Xian-He Bu A heterometallic strategy to achieve a large magnetocaloric effect in polymeric 3d complexes Chem.Commun. 51 (2015) 8288 Space group: P -3 1 c Cell volume: 789.6 Cell parameters: 8.1565; 8.1565; 13.705; 90; 90; 120;

COD ID: 7118348

Formula: - C38 H70 Na3 O32 S3 -
Comments: Garnett, Graham A. E.; Daze, Kevin D.; Peña Diaz, Jorge A; Fagen, Noah; Shaurya, Alok; Ma, Manuel C. F.; Collins, Mary S.; Johnson, Darren W.; Zakharov, Lev N.; Hof, Fraser Attraction by repulsion: compounds with like charges undergo self-assembly in water that improves in high salt and persists in real biological fluids. Chemical communications (Cambridge, England) 52(13) (2016) 2768-2771
Space group: P -3 1 c
Cell volume: 19186.9
Cell parameters: 27.0902; 27.0902; 30.1891; 90; 90; 120;

COD ID: 7118593

Formula: - C64 H24 Co3 N5 O18.75 -
Comments: Wang, Xiuli; Gao, Wen-Yang; Luan, Jian; Wojtas, Lukasz; Ma, Shengqian An effective strategy to boost the robustness of metal-organic frameworks via introduction of size-matching ligand braces. Chemical communications (Cambridge, England) 52(9) (2016) 1971-1974
Space group: P -3 1 c
Cell volume: 3446.66
Cell parameters: 15.3816; 15.3816; 16.8215; 90; 90; 120;

COD ID: 7121340
CIF file	Formula: - C90 H84 Cu6 In3 N12 O22 - Comments: Zhou, Mi; Ju, Zhanfeng; Yuan, Daqiang A new metal-organic framework constructed from cationic nodes and cationic linkers for highly efficient anion exchange Chemical Communications (2018) Space group: P -3 1 c Cell volume: 13868.9 Cell parameters: 23.0639; 23.0639; 30.1054; 90; 90; 120;

COD ID: 7123232

Formula: - C62 H33 Co F3 N12 O8 Ru -
Comments: Schmitt, Wolfgang; Martins, Luana; Macreadie, Lauren; Sensharma, Debobroto; Vaesen, Sebastien; Zhang, Xia; Gough, John; O'Doherty, Mariah; Zhu, Nianyong; Ruether, Manuel; O'Brien, John E; Bradley, A. Louise Light-harvesting, 3rd generation MOF with large, tubular channel aperture Chemical Communications (2019)
Space group: P -3 1 c
Cell volume: 6481.6
Cell parameters: 26.645; 26.645; 10.542; 90; 90; 120;

COD ID: 7128718

Formula: - Cr2 Dy6 Na6 Nb30 O148 -
Comments: Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian 3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties. Chemical communications (Cambridge, England) 57(69) (2021) 8624-8627
Space group: P -3 1 c
Cell volume: 9017.3
Cell parameters: 18.9817; 18.9817; 28.8986; 90; 90; 120;

COD ID: 7128719

Formula: - Dy6 Mn2 Na6 Nb30 O148 -
Comments: Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian 3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties. Chemical communications (Cambridge, England) 57(69) (2021) 8624-8627
Space group: P -3 1 c
Cell volume: 9055
Cell parameters: 19.0042; 19.0042; 28.9507; 90; 90; 120;

COD ID: 7128720

Formula: - Dy6 Fe2 Na6 Nb30 O151 -
Comments: Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian 3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties. Chemical communications (Cambridge, England) 57(69) (2021) 8624-8627
Space group: P -3 1 c
Cell volume: 9068.9
Cell parameters: 18.9931; 18.9931; 29.0291; 90; 90; 120;

COD ID: 7128721

Formula: - Co2 Dy6 Na6 Nb30 O141 -
Comments: Lin, Yu-Diao; Ge, Rui; Tian, Chong-Bin; Sun, Cai; Sun, Yan-Qiong; Zeng, Qing-Xin; Li, Xin-Xiong; Zheng, Shou-Tian 3d-4f Heterometallic cluster incorporated polyoxoniobates with magnetic properties. Chemical communications (Cambridge, England) 57(69) (2021) 8624-8627
Space group: P -3 1 c
Cell volume: 8947.2
Cell parameters: 19.0037; 19.0037; 28.6076; 90; 90; 120;

COD ID: 7130048
CIF file	Formula: - C8 H8 N Ni O6 - Comments: Zhang, Bin; Li, Xiu-Yuan; Lu, Yu-Ke; Hou, Lei; Wang, Yao-Yu; Zhu, Zhonghua C2H2 capture and separation in a MOF based on Ni6 trigonal-prismatic units Chemical Communications (2022) Space group: P -3 1 c Cell volume: 4887.2 Cell parameters: 18.104; 18.104; 17.218; 90; 90; 120;

COD ID: 7131874
CIF file	Formula: - C129 H192 Cu21 F12 N9 P2 S20 - Comments: Brocha Silalahi, Rhone P.; Chiu, Tzu-Hao; Liang, Hao; Kahlal, Samia; Saillard, Jean-Yves; Liu, Chen-Wei A heteroleptic fused bi-cuboctahedral Cu21S2 cluster Chemical Communications (2023) Space group: P -3 1 c Cell volume: 7781.9 Cell parameters: 17.3556; 17.3556; 29.8314; 90; 90; 120;

COD ID: 7200305
CIF file	Formula: - C75 H27 I2 N6 - Comments: Konarev, Dmitry V.; Khasanov, Salavat S.; Otsuka, Akihiro; Saito, Gunzi; Lyubovskaya, Rimma N. Ionic fullerene complex (DMI+)3·(C60˙−)·(I−)2 with 2H-hexagonal fullerene packing and 3-D DMI±I− network CrystEngComm 11(5) (2009) 811 Space group: P -3 1 c Cell volume: 2453 Cell parameters: 13.3617; 13.3617; 15.8651; 90; 90; 120;

COD ID: 7201411