Search results

Formula: - C39 H59 Au2 Br O2 P2 -
Comments: Wing-Wah Yam, Vivian; Cheung, Kai-Leung; Yip, Sung-Kong; Zhu, Nianyong Synthesis, characterisation, electrochemistry and luminescence studies of 9-anthrylgold(I) complexes. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 4(1) (2005) 149-153
Space group: P 1 2/a 1
Cell volume: 4731
Cell parameters: 17.211; 12.442; 22.955; 90; 105.75; 90;

COD ID: 1524100
CIF file	Formula: - In Nb O4 - Comments: Brixner, L.H.; Chen, H.-Y. On the structural and luminescent properties of the In Ta(1-x) Nb(x) O4 system Materials Research Bulletin 15 (1980) 607-612 Space group: P 1 2/a 1 Cell volume: 143.516 Cell parameters: 5.144; 5.7709; 4.8355; 90; 91.13; 90;

COD ID: 1524297
CIF file	Formula: - Al Li O10 Si4 - Comments: Effenberger, H. Petalit, Li Al Si4 O10: Verfeinerung der Kristallstruktur, Diskussion der Raumgruppe und Infrarot-Messung TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-) 27 (1980) 129-142 Space group: P 1 2/a 1 Cell volume: 424.136 Cell parameters: 11.754; 5.1395; 7.6296; 90; 113.04; 90;

COD ID: 1524917
CIF file	Formula: - Al1.1 B8 Ca5.24 Fe0.9 H8 La2.62 O48 Si8 Y2.62 - Comments: Mellini, M.; Merlino, S. Hellandite: a new type of silicoborate chain American Mineralogist 62 (1977) 89-99 Space group: P 1 2/a 1 Cell volume: 858.657 Cell parameters: 18.99; 4.715; 10.3; 90; 111.4; 90;

COD ID: 1528201
CIF file	Formula: - Co4 H38 N12 O30 S5 - Comments: Wieghardt, K.; Maas, G. Die Molekuel- und Kristallstruktur von Di-mue-sulfato-mue-hydroxo-bis(triammincobalt(III))-sul at 8-Hydrat Zeitschrift fuer Anorganische und Allgemeine Chemie 385 (1971) 289-296 Space group: P 1 2/a 1 Cell volume: 1704.14 Cell parameters: 14.122; 9.858; 18.81; 90; 139.4; 90;

COD ID: 1530793
CIF file	Formula: - Mg2 Na3 O16 P5 - Comments: Smolin, Yu.I.; Shepelev, Yu.F.; Domanskii, A.I.; Majling, J. A new type of phosphate radical P5 O16 in the Na3 Mg2 P5 O16 crystal Kristallografiya 23 (1978) 1264-1266 Space group: P 1 2/a 1 Cell volume: 659.242 Cell parameters: 18.617; 6.844; 5.174; 90; 90.15; 90;

COD ID: 1530904
CIF file	Formula: - Lu O4 Ta - Comments: Trunov, V.K.; Kinzhibalo, L.N.; Efremov, V.A.; Krongauz, V.G. On the m' - structure of 'orthotantalates' of the rare earth elements Doklady Akademii Nauk SSSR 260 (1981) 103-106 Space group: P 1 2/a 1 Cell volume: 143.062 Cell parameters: 5.24; 5.424; 5.062; 90; 96.08; 90;

COD ID: 1530905
CIF file	Formula: - Er O4 Ta - Comments: Trunov, V.K.; Kinzhibalo, L.N.; Efremov, V.A.; Krongauz, V.G. On the m' - structure of 'orthotantalates' of the rare earth elements Doklady Akademii Nauk SSSR 260 (1981) 103-106 Space group: P 1 2/a 1 Cell volume: 146.006 Cell parameters: 5.29; 5.443; 5.103; 90; 96.44; 90;

COD ID: 1530906
CIF file	Formula: - Dy O4 Ta - Comments: Trunov, V.K.; Krongauz, V.G.; Kinzhibalo, L.N.; Efremov, V.A. On the m' - structure of the 'orthotantalates' of the rare-earth elements Doklady Akademii Nauk SSSR 260 (1981) 103-106 Space group: P 1 2/a 1 Cell volume: 148.357 Cell parameters: 5.319; 5.472; 5.131; 90; 96.58; 90;

COD ID: 1530907
CIF file	Formula: - Gd O4 Ta - Comments: Trunov, V.K.; Krongauz, V.G.; Efremov, V.A.; Kinzhibalo, L.N. On the m' - structure of the 'orthotantalates' of the rare-earth elements Doklady Akademii Nauk SSSR 260 (1981) 103-106 Space group: P 1 2/a 1 Cell volume: 151.367 Cell parameters: 5.356; 5.506; 5.168; 90; 96.69; 90;

COD ID: 1530908
CIF file	Formula: - O4 Ta Y - Comments: Trunov, V.K.; Efremov, V.A.; Kinzhibalo, L.N.; Krongauz, V.G. On the m' - structure of the 'orthotantalates' of the rare-earth elements Doklady Akademii Nauk SSSR 260 (1981) 103-106 Space group: P 1 2/a 1 Cell volume: 146.972 Cell parameters: 5.302; 5.454; 5.115; 90; 96.46; 90;

COD ID: 1531309

Formula: - Al0.5 B3.99 Be1.18 Ca4.37 Ce1.46 F0.53 Fe0.38 H0.43 Li0.02 Mg0.03 O23.47 Si3.98 Th0.17 Ti0.07 -
Comments: della Ventura, G.; Bonazzi, P.; Oberti, R.; Ottolini, L. Ciprianiite and Mottanaite-(Ce), two new minerals of the Hellandite group from Latium (Italy) American Mineralogist 87 (2002) 739-744
Space group: P 1 2/a 1
Cell volume: 864.351
Cell parameters: 19.032; 4.746; 10.248; 90; 110.97; 90;

COD ID: 1531310

Formula: - Al0.48 B4 Be0.82 Ca4.6 Ce0.74 F0.49 Fe0.4 H0.54 Li0.04 Mg0.05 O23.51 Si4 Th0.66 Ti0.1 -
Comments: della Ventura, G.; Bonazzi, P.; Oberti, R.; Ottolini, L. Ciprianiite and Mottanaite-(Ce), two new minerals of the Hellandite group from Latium (Italy) American Mineralogist 87 (2002) 739-744
Space group: P 1 2/a 1
Cell volume: 863.993
Cell parameters: 19.059; 4.729; 10.291; 90; 111.33; 90;

COD ID: 1534277
CIF file	Formula: - Mo8.5 O29 W1.5 - Comments: Blomberg, B.; Magneli, A.; Kihlborg, L. The crystal structures of (Mo, W)10 O29 And (Mo, W)11 O32 Arkiv foer Kemi 6 (1953) 133-138 Space group: P 1 2/a 1 Cell volume: 1110.96 Cell parameters: 17; 4; 17.5; 90; 111; 90;

COD ID: 1534278
CIF file	Formula: - Mo9.35 O32 W1.65 - Comments: Blomberg, B.; Kihlborg, L.; Magneli, A. The crystal structures of (Mo, W)10 O29 And (Mo, W)11 O32 Arkiv foer Kemi 6 (1953) 133-138 Space group: P 1 2/a 1 Cell volume: 1193.58 Cell parameters: 16.6; 4; 18.7; 90; 74; 90;

COD ID: 1534890
CIF file	Formula: - Mo9 O26 - Comments: Magneli, A. The crystal structures of Mo9 O26 (beta'-molybdenum oxide ) and Mo8 O23 (beta-molybdenum oxide) Acta Chemica Scandinavica (1-27,1973-42,1988) 2 (1948) 501-517 Space group: P 1 2/a 1 Cell volume: 970.068 Cell parameters: 16.75; 4.03; 14.45; 90; 96; 90;

COD ID: 1535553
CIF file	Formula: - O4 Ta Y - Comments: Brixner, L.H.; Chen, H.-Y. On the structural and luminescent properties of the M' Ln Ta O4 Rare Earth tantalates Journal of the Electrochemical Society 130 (1983) 2435-2443 Space group: P 1 2/a 1 Cell volume: 146.668 Cell parameters: 5.298; 5.451; 5.111; 90; 96.45; 90;

COD ID: 1536725
CIF file	Formula: - Mo6.48 O25 W2.52 - Comments: Portemer, F.; Figlarz, M.; Kihlborg, L.; Sundberg, M.R. Homologues of Mo4 O11 (mon) in the Mo-W-O system prepared by soft chemistry Journal of Solid State Chemistry 103 (1993) 403-414 Space group: P 1 2/a 1 Cell volume: 995.475 Cell parameters: 50.64; 5.439; 6.701; 90; 32.64; 90;

COD ID: 1542093
CIF file	Formula: - C3 Cr K3 N3 O4 - Comments: Stomberg, R. The crystal structure of potassiumdiperoxotricyanochromate(IV), K3 (Cr (O2)2 (C N)3) Arkiv foer Kemi 23 (1965) 401-430 Space group: P 1 2/a 1 Cell volume: 993.032 Cell parameters: 11.526; 7.628; 12.108; 90; 111.12; 90;

COD ID: 1544614

Formula: - E1.19 Nb0.39 O4 R Ta0.58 Ti0.02 Y0.81 -
Comments: Hori, H.; Kobayashi, T.; Miyawaki, R.; Matsubara, S.; Yokoyama, K.; Shimizu, M. Iwashiroite-(Y), YTaO3, a new mineral from Suishoyama, Kawamata town, Fukushima Prefecture, Japan Journal of Mineralogical and Petrological Sciences 101 (2006) 170-177
Space group: P 1 2/a 1
Cell volume: 146.8
Cell parameters: 5.292; 5.452; 5.1149; 90; 95.89; 90;

COD ID: 1550016
CIF file	Formula: - Al O4 P - Comments: Kanzaki, M. Temperature-induced phase transition of AlPO4-moganite studies by in-situ Raman spectroscopy : alpha phase model optimized by DFT Journal of Mineralogical and Petrological Sciences 113 (2018) 126-134 Space group: P 1 2/a 1 Cell volume: 470.599 Cell parameters: 8.7802; 4.9087; 10.9191; 90; 90.33; 90;

COD ID: 2001554
CIF file Original IUCr paper	Formula: - C14 H13 N O2 - Comments: Yeap, G.-Y.; Teo, S.-B.; Fun, H.-K.; Teoh, S.-G. Structure of 4-[(3-methoxyphenylimino)methyl]phenol Acta Crystallographica Section C 49(7) (1993) 1396-1398 Space group: P 1 2/a 1 Cell volume: 1155.8 Cell parameters: 12.248; 8.637; 10.934; 90; 92.25; 90;

COD ID: 2002235
CIF file	Formula: - Fe Nb O4 - Comments: Harder, M; Mueller-Buschbaum, Hk Fe Nb O4. Untersuchungen an Einkristallen mit Wolframit-und Al Nb O4- Struktur Zeitschrift fuer Anorganische und Allgemeine Chemie 456 (1979) 99-105 Space group: P 1 2/a 1 Cell volume: 129.8 Cell parameters: 4.992; 5.607; 4.637; 90; 90.06; 90;

COD ID: 2004068
CIF file Original IUCr paper	Formula: - C17 H29 N O4 S3 - Comments: Ng, S. W. Bis(dicyclohexylammonium) Trithiocarbodiglycolate Trithiocarbodiglycolic Acid Acta Crystallographica Section C 51(10) (1995) 2150-2152 Space group: P 1 2/a 1 Cell volume: 2027.7 Cell parameters: 10.664; 9.829; 20.058; 90; 105.315; 90;

COD ID: 2007716
CIF file Original IUCr paper	Formula: - C10 H16 O3 S - Comments: Muir, Kenneth W.; Rodger, Colin S.; Morris, David G.; Ryder, Karl S. A Sultone Derived from Racemic Camphene Acta Crystallographica Section C 54(10) (1998) 1546-1548 Space group: P 1 2/a 1 Cell volume: 1063.81 Cell parameters: 10.5933; 8.8517; 11.3495; 90; 91.606; 90;

COD ID: 2009664
CIF file Original IUCr paper	Formula: - C22 H34 - Comments: Spek, Anthony L.; Timmermans, Petrus J. J. A.; Mackor, Adri <i>trans</i>-<i>transoid</i>-<i>trans</i>-<i>transoid</i>-<i>trans</i>-Tetracyclo[16.4.0.0^2,9^.0^10,17^]docosa-5,13-diene Acta Crystallographica Section C 50(5) (1994) 744-746 Space group: P 1 2/a 1 Cell volume: 1776.4 Cell parameters: 14.742; 9.078; 15.162; 90; 118.9; 90;

COD ID: 2012773

Formula: - C14 H10 Cd O6 -
Comments: Hu, Mao-Lin; Gao, Peng; Ng, Seik Weng Aqua(4,4'-oxydibenzoato-κO)cadmium(II) Acta Crystallographica Section C 58(6) (2002) m323-m324
Space group: P 1 2/a 1
Cell volume: 665.6
Cell parameters: 7.307; 6.453; 14.423; 90; 101.83; 90;

COD ID: 2101832

Formula: - C21 H28 N2 O2 -
Comments: Ferguson, George Crystal Engineering Using Bisphenols. Chains, Ladders and Sheets Formed by the Adducts of 1,4-Diazabicyclo[2.2.2]octane with Bisphenols: Structures of Adducts with 4,4'-Isopropylidenediphenol (1/1), 4,4'-Oxodiphenol (1/1) and 4,4'-Thiodiphenol (1/1 and 2/1) Acta Crystallographica Section B 53(3) (1997) 513-520
Space group: P 1 2/a 1
Cell volume: 970.3
Cell parameters: 11.385; 6.5565; 13.076; 90; 96.24; 90;

COD ID: 2107345

Formula: - Li1.16 Mg38.63 O124 Sc3.1 Si40.07 -
Comments: Takeuchi, Y.; Ito, J.; Kudoh, Y. New Series of Superstructures Based on Clinopyroxene. I. The Structure of the 'Enstatite-IV' Series, (Mg(x-12)/3 Sc4) (Li4/3 Si(x-4)/3) Ox, with x = 100, 112 or 124 Acta Crystallographica B (39,1983-) 40 (1984) 115-125
Space group: P 1 2/a 1
Cell volume: 2226.64
Cell parameters: 9.429; 8.748; 27.038; 90; 93.25; 90;

COD ID: 2107346

Formula: - Li1.33 Mg28.4 O100 Sc4.62 Si32 -
Comments: Takeuchi, Y.; Kudoh, Y.; Ito, J. New Series of Superstructures Based on Clinopyroxene. I. The Structure of the 'Enstatite-IV' Series, (Mg(x-12)/3 Sc4) (Li4/3 Si(x-4)/3) Ox, with x = 100, 112 or 124 Acta Crystallographica B (39,1983-) 40 (1984) 115-125
Space group: P 1 2/a 1
Cell volume: 1797
Cell parameters: 9.429; 8.741; 21.808; 90; 91.2; 90;

COD ID: 2108790
CIF file HKL data	Formula: - C3 H17 Al N2 O14 S2 - Comments: Zarychta, Bartosz; Czapla, Zbigniew; Przesławski, Janusz; Szklarz, Przemysław Structure, ferroelasticity and Goldilocks zone phase transitions in C~3~H~5~N~2~Al(SO~4~)~2~·6H~2~O Acta Crystallographica Section B 77(2) (2021) Space group: P 1 2/a 1 Cell volume: 741.07 Cell parameters: 12.0026; 6.7859; 9.1005; 90; 88.835; 90;

COD ID: 2205301

Formula: - C16 H10 N4 O2 -
Comments: Imoda, Tomohiko; Hirota, Tsuyoshi; Takahashi, Hiroo; Mizuguchi, Jin 3,6-Di-2-pyridylpyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione Acta Crystallographica Section E 61(3) (2005) o616-o618
Space group: P 1 2/a 1
Cell volume: 1214.6
Cell parameters: 16.097; 3.7144; 21.725; 90; 110.758; 90;

COD ID: 2206159

Formula: - C16 H12 Br N4 O3.5 -
Comments: Ali, Hapipah M.; Abdul Halim, Siti Nadiah; Ng, Seik Weng 5-Bromo-1H-indole-3-carbaldehyde 2-nitrophenylhydrazone hemihydrate Acta Crystallographica Section E 61(7) (2005) o2308-o2309
Space group: P 1 2/a 1
Cell volume: 1572.4
Cell parameters: 16.547; 6.053; 16.924; 90; 111.93; 90;

COD ID: 2311064
CIF file	Formula: - Mo5.5 O32 W5.5 - Comments: Magneli, A. Structures of the Re O3 - type with Recurrent Dislocations of Atoms: 'Homologous Series' of Molybdenum and Tungsten Oxides Acta Crystallographica (1,1948-23,1967) 6 (1953) 495-500 Space group: P 1 2/a 1 Cell volume: 1193.58 Cell parameters: 16.59999; 4; 18.7; 90; 74; 90;

COD ID: 2311067
CIF file	Formula: - Mo5 O29 W5 - Comments: Magneli, A. Structures of the Re O3 - type with recurrent dislocations of atoms: 'homologous series' of molybdenum and tungsten oxides Acta Crystallographica (1,1948-23,1967) 6 (1953) 495-500 Space group: P 1 2/a 1 Cell volume: 1110.96 Cell parameters: 17; 4; 17.5; 90; 111; 90;

COD ID: 3000295
CIF file	Formula: - Ag Cr P2 S6 - Comments: Selter, Sebastian; Shemerliuk, Yuliia; Buechner, Bernd; Aswartham, Saicharan Crystal Growth of the Quasi-2D Quarternary Compound Ag Cr P2 S6 by Chemical Vapor Transport Crystals 11 (2021) 500 Space group: P 1 2/a 1 Cell volume: 405.07 Cell parameters: 5.88318; 10.6214; 6.745; 90; 106.043; 90;

COD ID: 4023793

Formula: - C24 H18 Ag F6 N6 P -
Comments: Yajun Ma; Siping Wei; Jingbo Lan; Jingzhi Wang; Rugang Xie; Jingsong You Pyrido[1,2-a][1,2,4]triazol-3-ylidenes as a New Family of Stable Annulated N-Heterocyclic Carbenes: Synthesis, Reactivity, and Their Application in Coordination Chemistry and Organocatalysis Journal of Organic Chemistry 73 (2008) 8256-8264
Space group: P 1 2/a 1
Cell volume: 2418.8
Cell parameters: 12.484; 7.148; 27.263; 90; 96.14; 90;

COD ID: 4030742

Formula: - C4 H4 Ce Li O10 -
Comments: Romero, S.; Mosset, A.; Trombe, J.-C. Synthesis, characterization and structure of two new families of mixed oxalates; [M(Ln(H2O)n](C2O4).H2O with M = Li, Ln = La...Gd, n=1 or M = Na, Ln = Ce...Nd, n = 2 European Journal of Solid State and Inorganic Chemistry 32 (1995) 1053-1063
Space group: P 1 2/a 1
Cell volume: 908.38
Cell parameters: 9.39; 7.678; 12.992; 90; 104.12; 90;

COD ID: 4030743

Formula: - C4 H6 Ce Na O11 -
Comments: Romero, S.; Mosset, A.; Trombe, J.-C. Synthesis, characterization and structure of two new families of mixed oxalates; [M(Ln(H2O)n](C2O4).H2O with M = Li, Ln = La...Gd, n=1 or M = Na, Ln = Ce...Nd, n = 2 European Journal of Solid State and Inorganic Chemistry 32 (1995) 1053-1063
Space group: P 1 2/a 1
Cell volume: 984.56
Cell parameters: 10.066; 7.614; 13.139; 90; 102.12; 90;

COD ID: 4068875

Formula: - C27 H36 N2 O2 Si W -
Comments: Suzuki, Eiji; Komuro, Takashi; Okazaki, Masaaki; Tobita, Hiromi Synthesis and Characterization of DMAP-Stabilized Aryl(silylene) Complexes and (Arylsilyl)(DMAP) Complexes of Tungsten: Mechanistic Study on the Interconversion between These Complexes via 1,2-Aryl Migration Organometallics 28(6) (2009) 1791
Space group: P 1 2/a 1
Cell volume: 2635.3
Cell parameters: 17.6549; 8.69; 17.7595; 90; 104.716; 90;

COD ID: 4070456
CIF file	Formula: - C16 H24 Cl2 N3 P Pd S - Comments: Schuster, Elaine M.; Botoshansky, Mark; Gandelman, Mark Versatile, Selective, and Switchable Coordination Modes of Pincer Click Ligands Organometallics 28(24) (2009) 7001 Space group: P 1 2/a 1 Cell volume: 4285.1 Cell parameters: 13.41; 13.946; 23.514; 90; 102.98; 90;

COD ID: 4073211
CIF file	Formula: - C10 H10 F V - Comments: Harvey, Benjamin G.; Arif, Atta M.; Glöckner, Andreas; Ernst, Richard D. SF6as a Selective and Reactive Fluorinating Agent for Low-Valent Transition Metal Complexes# Organometallics 26(11) (2007) 2872 Space group: P 1 2/a 1 Cell volume: 854.58 Cell parameters: 9.7874; 6.3569; 14.2795; 90; 105.868; 90;

COD ID: 4076530
CIF file	Formula: - C19 H31 B Cl N4 O Si - Comments: Cade, Ian A.; Hill, Anthony F. 1,1-Bis(N-methylimidazole)-2-(trimethylsilyl)-1-boracyclohexa-1,4-diene Chloride: A Stable Intermediate or Tangent en Route to 1-(N-Methylimidazole)borabenzene? Organometallics 31(5) (2012) 2112 Space group: P 1 2/a 1 Cell volume: 2277.44 Cell parameters: 12.7787; 10.0476; 18.6854; 90; 108.326; 90;

COD ID: 4111482

Formula: - C68 H83 N4 O4.5 S2 Zn2 -
Comments: Bun Yeoul Lee; Heon Yong Kwon; Su Yeon Lee; Sung Jae Na; Song-i Han; Hoseop Yun; Hyosun Lee; Young-Whan Park Bimetallic Anilido-Aldimine Zinc Complexes for Epoxide/CO2 Copolymerization Journal of the American Chemical Society 127 (2005) 3031-3037
Space group: P 1 2/a 1
Cell volume: 6756.9
Cell parameters: 24.4623; 12.9181; 24.3219; 90; 118.462; 90;

COD ID: 4111985

Formula: - C36 H40 -
Comments: Matthijs K. J. ter Wiel; Richard A. van Delden; Auke Meetsma; Ben L. Feringa Light-Driven Molecular Motors: Stepwise Thermal Helix Inversion during Unidirectional Rotation of Sterically Overcrowded Biphenanthrylidenes Journal of the American Chemical Society 127 (2005) 14208-14222
Space group: P 1 2/a 1
Cell volume: 2702.5
Cell parameters: 18.161; 7.3428; 22.132; 90; 113.698; 90;

COD ID: 4112209

Formula: - C20 H29 N O2 -
Comments: Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society 126 (2004) 1764-1771
Space group: P 1 2/a 1
Cell volume: 1812.79
Cell parameters: 10.8715; 4.8081; 34.691; 90; 91.415; 90;

COD ID: 4112210

Formula: - C21 H31 N O2 -
Comments: Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society 126 (2004) 1764-1771
Space group: P 1 2/a 1
Cell volume: 1906.9
Cell parameters: 10.8779; 4.7946; 36.692; 90; 94.818; 90;

COD ID: 4112211

Formula: - C26 H41 N O2 -
Comments: Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society 126 (2004) 1764-1771
Space group: P 1 2/a 1
Cell volume: 2424.4
Cell parameters: 10.9392; 4.8173; 46.006; 90; 89.678; 90;

COD ID: 4112212

Formula: - C31 H51 N O2 -
Comments: Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society 126 (2004) 1764-1771
Space group: P 1 2/a 1
Cell volume: 2897.3
Cell parameters: 10.905; 4.837; 54.96; 90; 91.938; 90;

COD ID: 4112216

Formula: - C16 H21 N O2 -
Comments: Kazuki Sada; Katsunari Inoue; Tomoyuki Tanaka; Akira Tanaka; Attila Epergyes; Sadamu Nagahama; Akikazu Matsumoto; Mikiji Miyata Organic Layered Crystals with Adjustable Interlayer Distances of 1-Naphthylmethylammoniumn-Alkanoates and Isomerism of Hydrogen-Bond Networks by Steric Dimension Journal of the American Chemical Society 126 (2004) 1764-1771
Space group: P 1 2/a 1
Cell volume: 1443.5
Cell parameters: 10.871; 4.9114; 27.191; 90; 96.117; 90;

COD ID: 4117783

Formula: - C168.25 B0 N8 O80 Pd4 Si2 W20 -
Comments: Tomohisa Hirano; Kazuhiro Uehara; Keigo Kamata; Noritaka Mizuno Palladium(II) Containing γ-Keggin Silicodecatungstate That Efficiently Catalyzes Hydration of Nitriles Journal of the American Chemical Society 134 (2012) 6425-6433
Space group: P 1 2/a 1
Cell volume: 26939.4
Cell parameters: 20.2918; 45.0388; 29.4768; 90; 89.94; 90;

COD ID: 4122509
CIF file	Formula: - C30 H13.44 B Br1.56 - Comments: Matsuo, Kyohei; Saito, Shohei; Yamaguchi, Shigehiro Photodissociation of B-N Lewis adducts: a partially fused trinaphthylborane with dual fluorescence. Journal of the American Chemical Society 136(36) (2014) 12580-12583 Space group: P 1 2/a 1 Cell volume: 1922.03 Cell parameters: 23.4202; 3.8518; 23.7888; 90; 116.409; 90;

COD ID: 4130109

Formula: - C36 H49 B N2 O -
Comments: Kisu, Haruki; Sakaino, Hirotoshi; Ito, Fumihiro; Yamashita, Makoto; Nozaki, Kyoko A Qualitative Analysis of a "Bora-Brook Rearrangement": The Ambident Reactivity of Boryl-Substituted Alkoxide Including the Carbon-to-Oxygen Migration of a Boryl Group. Journal of the American Chemical Society 138(10) (2016) 3548-3552
Space group: P 1 2/a 1
Cell volume: 3240.2
Cell parameters: 15.408; 11.14; 18.912; 90; 93.473; 90;

COD ID: 4302194

Formula: - C36 H35.5 Cl2 N7.5 Ni O13.5 -
Comments: Atsushi Kunishita; Yoshitaka Doi; Minoru Kubo; Takashi Ogura; Hideki Sugimoto; Shinobu Itoh Ni(II)/H2O2 Reactivity in Bis[(pyridin-2-yl)methyl]amine Tridentate Ligand System. Aromatic Hydroxylation Reaction by Bis(μ-oxo)dinickel(III) Complex Inorganic Chemistry 48 (2009) 4997-5004
Space group: P 1 2/a 1
Cell volume: 3949
Cell parameters: 17.66; 11.152; 20.295; 90; 98.86; 90;

COD ID: 4305978
CIF file	Formula: - C20 H48.7 Cl2 N3 O4.35 Rh S3 - Comments: Nobuto Yoshinari; Takumi Konno Separation and Optical Resolution of a Pair of atrop Diastereomers of the Octahedral Rhodium(III) Complex with a Nine-Membered S,S-Chelate Ring Inorganic Chemistry 47 (2008) 7450-7452 Space group: P 1 2/a 1 Cell volume: 9883 Cell parameters: 18.478; 22.337; 24.275; 90; 99.449; 90;

COD ID: 4307763

Formula: - C82 H100.4 N26 Ni7 O32.2 -
Comments: Theocharis C. Stamatatos; Eleanna Diamantopoulou; Catherine P. Raptopoulou; Vassilis Psycharis; Albert Escuer; Spyros P. Perlepes Acetate/Di-2-pyridyl Ketone Oximate "Blend" as a Source of High-Nuclearity Nickel(II) Clusters: Dependence of the Nuclearity on the Nature of the Inorganic Anion Present Inorganic Chemistry 46 (2007) 2350-2352
Space group: P 1 2/a 1
Cell volume: 5319
Cell parameters: 21.475; 21.955; 11.352; 90; 96.393; 90;

COD ID: 4311696

Formula: - C14 H10 O6 Zn -
Comments: Mitsuru Kondo; Yasuhiko Irie; Yusuke Shimizu; Makoto Miyazawa; Hiroyuki Kawaguchi; Akira Nakamura; Tetsuyoshi Naito; Kenji Maeda; Fumio Uchida Dynamic Coordination Polymers with 4,4'-Oxybis(benzoate): Reversible Transformations of Nano- and Nonporous Coordination Frameworks Responding to Present Solvents Inorganic Chemistry 43 (2004) 6139-6141
Space group: P 1 2/a 1
Cell volume: 642.5
Cell parameters: 7.391; 6.273; 14.256; 90; 103.572; 90;

COD ID: 4312644
CIF file	Formula: - C54 H42 Cl2 N5 Ni O - Comments: Ziwei Xiao; Brian O. Patrick; David Dolphin Ni(III) Complex of an N-Confused Porphyrin Inner C-Oxide Inorganic Chemistry 42 (2003) 8125-8127 Space group: P 1 2/a 1 Cell volume: 4721.6 Cell parameters: 21.2291; 8.6451; 25.7622; 90; 93.004; 90;

COD ID: 4318248

Formula: - C54 H97 N4 O2.5 P4 Pt2 -
Comments: Bao-Hui Xia; Chi-Ming Che; David Lee Phillips; King-Hung Leung; Kung-Kai Cheung Metal-Metal Interactions in Dinuclear d8 Metal Cyanide Complexes Supported by Phosphine Ligands. Spectroscopic Properties and ab Initio Calculations of [M2(μ-diphosphine)2(CN)4] and trans-[M(phosphine)2(CN)2] (M = Pt, Ni) Inorganic Chemistry 41 (2002) 3866-3875
Space group: P 1 2/a 1
Cell volume: 6236.7
Cell parameters: 18.097; 14.759; 23.701; 90; 99.87; 90;

COD ID: 4318250

Formula: - C54 H97 N4 Ni2 O2.5 P4 -
Comments: Bao-Hui Xia; Chi-Ming Che; David Lee Phillips; King-Hung Leung; Kung-Kai Cheung Metal-Metal Interactions in Dinuclear d8 Metal Cyanide Complexes Supported by Phosphine Ligands. Spectroscopic Properties and ab Initio Calculations of [M2(μ-diphosphine)2(CN)4] and trans-[M(phosphine)2(CN)2] (M = Pt, Ni) Inorganic Chemistry 41 (2002) 3866-3875
Space group: P 1 2/a 1
Cell volume: 6159.8
Cell parameters: 17.999; 14.513; 23.895; 90; 99.298; 90;

COD ID: 4329330
CIF file	Formula: - Al3 O12 P3 - Comments: Masami Kanzaki; Xianyu Xue Structural Characterization of Moganite-Type AlPO4 by NMR and Powder X-ray Diffraction Inorganic Chemistry 51 (2012) 6164-6172 Space group: P 1 2/a 1 Cell volume: 461.364 Cell parameters: 8.7438; 4.85855; 10.8602; 90; 90.1276; 90;

COD ID: 4338634
CIF file	Formula: - C24 H36 Al Cl2 N P2 - Comments: Lee, Pei-Ying; Liang, Lan-Chang Synthesis and Structural Characterization of Five-Coordinate Aluminum Complexes Containing Diarylamido Diphosphine Ligands Inorganic chemistry 48(12) (2009) 5480-5487 Space group: P 1 2/a 1 Cell volume: 2625.13 Cell parameters: 17.2082; 9.2626; 18.4636; 90; 116.874; 90;

COD ID: 4512562

Formula: - O10 Ti6 -
Comments: Tanaka, Kenji; Nasu, Tomomichi; Miyamoto, Yasuto; Ozaki, Noriaki; Tanaka, Shu; Nagata, Toshiaki; Hakoe, Fumiyoshi; Yoshikiyo, Marie; Nakagawa, Kosuke; Umeta, Yoshikazu; Imoto, Kenta; Tokoro, Hiroko; Namai, Asuka; Ohkoshi, Shin-ichi Structural Phase Transition between γ-Ti3O5and δ-Ti3O5by Breaking of a One-Dimensionally Conducting Pathway Crystal Growth & Design 15(2) (2015) 653
Space group: P 1 2/a 1
Cell volume: 343.15
Cell parameters: 9.9651; 5.0604; 7.2114; 90; 109.332; 90;

COD ID: 4513241

Formula: - C10 H11 I N2 O2 -
Comments: Makhotkina, Olena; Lieffrig, Julien; Jeannin, Olivier; Fourmigué, Marc; Aubert, Emmanuel; Espinosa, Enrique Cocrystal or Salt: Solid State-Controlled Iodine Shift in Crystalline Halogen-Bonded Systems Crystal Growth & Design 15(7) (2015) 3464
Space group: P 1 2/a 1
Cell volume: 1137.79
Cell parameters: 7.7617; 14.5317; 10.6247; 90; 108.296; 90;

COD ID: 7005395
CIF file	Formula: - C63 H63 Cl3 N8 O11 Zn - Comments: Halime, Zakaria; Lachkar, Mohammed; Toupet, Loïc; Coutsolelos, Athanassios G.; Boitrel, Bernard Coordination and structural studies of crowned-porphyrins. Dalton transactions (Cambridge, England : 2003) (issue 33) (2007) 3684-3689 Space group: P 1 2/a 1 Cell volume: 6066.2 Cell parameters: 23.755; 8.6928; 30.912; 90; 108.134; 90;

COD ID: 7014690

Formula: - C72 H64 N4 V2 -
Comments: Chang, Kai-Chieh; Lu, Chia-Fu; Wang, Po-Yang; Lu, Duan-Yen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou Ligand-controlled synthesis of vanadium(i) β-diketiminates and their catalysis in cyclotrimerization of alkynes. Dalton transactions (Cambridge, England : 2003) 40(10) (2011) 2324-2331
Space group: P 1 2/a 1
Cell volume: 5542.7
Cell parameters: 24.8878; 9.5634; 25.2169; 90; 112.559; 90;

COD ID: 7016031

Formula: - C81 H116 N Na O10 Ta2 -
Comments: Watanabe, Takahito; Kurogi, Takashi; Ishida, Yutaka; Kawaguchi, Hiroyuki Insertion and reduction chemistry of isocyanide with a cyclometalated ditantalum hydride complex. Dalton transactions (Cambridge, England : 2003) 40(30) (2011) 7701-7703
Space group: P 1 2/a 1
Cell volume: 8583.7
Cell parameters: 22.166; 13.5778; 29.333; 90; 103.516; 90;

COD ID: 7017384

Formula: - C47 H56 Mg N4 -
Comments: Hill, Michael S.; Kociok-Köhn, Gabriele; Macdougall, Dugald J.; Mahon, Mary F.; Weetman, Catherine Magnesium hydrides and the dearomatisation of pyridine and quinoline derivatives. Dalton transactions (Cambridge, England : 2003) 40(46) (2011) 12500-12509
Space group: P 1 2/a 1
Cell volume: 4153.68
Cell parameters: 18.3245; 10.8579; 22.0748; 90; 108.966; 90;

COD ID: 7021334

Formula: - C62 H86 Cl2 Nb O4 -
Comments: Kurogi, Takashi; Ishida, Yutaka; Hatanaka, Tsubasa; Kawaguchi, Hiroyuki Reduction of carbon monoxide by a tetrakis(aryloxide)diniobium complex having four bridging hydrides. Dalton transactions (Cambridge, England : 2003) 42(21) (2013) 7510-7513
Space group: P 1 2/a 1
Cell volume: 5316
Cell parameters: 21.571; 10.906; 24.181; 90; 110.853; 90;

COD ID: 7027141

Formula: - C70.5 H71 F24 N12 O5.5 P4 Ru2 -
Comments: Heirtzler, Fenton R.; Neuburger, Markus; Zehnder, Margareta; Bird, Steven J.; Orrell, Keith G.; Sik, Vladimir Synthesis, 1H/13C NMR spectroscopic and structural studies of sterically induced internal dynamics in novel mono- and di-ruthenium(II) 2,2′∶6′,2″-terpyridine complexes of 2,3-bis(2,2′-bipyridin-6-yl)pyrazine Journal of the Chemical Society, Dalton Transactions (issue 4) (1999) 565
Space group: P 1 2/a 1
Cell volume: 9048
Cell parameters: 23.288; 13.901; 29.507; 90; 108.7; 90;

COD ID: 7051108
CIF file	Formula: - C36 H88 Cl3 Cu4 N11 O24 - Comments: Chaudhuri, N. R.; Hibbs, W.; Maji, T. K.; Mostafa, G.; Mukherjee, Partha Sarathi New Journal of Chemistry (2001) Space group: P 1 2/a 1 Cell volume: 1496.2 Cell parameters: 11.798; 9.585; 14.167; 90; 110.95; 90;

COD ID: 7053227
CIF file	Formula: - C25 H57 F6 P2 Pd Sb - Comments: Walter, Marc D.; White, Peter S.; Brookhart, Maurice Synthesis, structure and computational studies of a cationic T-shaped Pd-complex New Journal of Chemistry 37(4) (2013) 1128 Space group: P 1 2/a 1 Cell volume: 3152.4 Cell parameters: 14.5334; 14.2796; 15.2101; 90; 92.956; 90;

COD ID: 7116943

Formula: - C22 K N9 O2 -
Comments: Yumi Yakiyama; Gil Ryeong Lee; Sung Yeon Kim; Yoshitaka Matsushita; Yasushi Morita; Moon Jeong Park; Masaki Kawano Formation of a nanometer-thick water layer at high humidity on a dynamic crystalline material composed of multi-interactive molecules Chem.Commun. 51 (2015) 6828
Space group: P 1 2/a 1
Cell volume: 3129
Cell parameters: 20.904; 15.931; 9.711; 90; 104.65; 90;

COD ID: 7116944

Formula: - C22 K N9 O6 -
Comments: Yumi Yakiyama; Gil Ryeong Lee; Sung Yeon Kim; Yoshitaka Matsushita; Yasushi Morita; Moon Jeong Park; Masaki Kawano Formation of a nanometer-thick water layer at high humidity on a dynamic crystalline material composed of multi-interactive molecules Chem.Commun. 51 (2015) 6828
Space group: P 1 2/a 1
Cell volume: 5449
Cell parameters: 20.656; 15.978; 16.801; 90; 100.68; 90;

COD ID: 7132758

Formula: - C6 H10 Er N O8 -
Comments: Hitchings, Thomas J.; Scatena, Rebecca; Allan, David R.; Cairns, Andrew B.; Saines, Paul J. Negative linear compressibility exhibited by the hybrid perovskite [(NH2)3C]Er(HCO2)2(C2O4). Chemical communications (Cambridge, England) 60(24) (2024) 3271-3274
Space group: P 1 2/a 1
Cell volume: 518.3
Cell parameters: 9.0759; 8.863; 6.4822; 90; 96.228; 90;

COD ID: 7132759

Formula: - C6 H10 Er N O8 -
Comments: Hitchings, Thomas J.; Scatena, Rebecca; Allan, David R.; Cairns, Andrew B.; Saines, Paul J. Negative linear compressibility exhibited by the hybrid perovskite [(NH2)3C]Er(HCO2)2(C2O4). Chemical communications (Cambridge, England) 60(24) (2024) 3271-3274
Space group: P 1 2/a 1
Cell volume: 523.5
Cell parameters: 9.0907; 8.903; 6.5091; 90; 96.38; 90;

COD ID: 7132761

Formula: - C6 H10 Er N O8 -
Comments: Hitchings, Thomas J.; Scatena, Rebecca; Allan, David R.; Cairns, Andrew B.; Saines, Paul J. Negative linear compressibility exhibited by the hybrid perovskite [(NH2)3C]Er(HCO2)2(C2O4). Chemical communications (Cambridge, England) 60(24) (2024) 3271-3274
Space group: P 1 2/a 1
Cell volume: 508.8
Cell parameters: 9.0471; 8.792; 6.4339; 90; 96.131; 90;

COD ID: 7132763

Formula: - C6 H10 Er N O8 -
Comments: Hitchings, Thomas J.; Scatena, Rebecca; Allan, David R.; Cairns, Andrew B.; Saines, Paul J. Negative linear compressibility exhibited by the hybrid perovskite [(NH2)3C]Er(HCO2)2(C2O4). Chemical communications (Cambridge, England) 60(24) (2024) 3271-3274
Space group: P 1 2/a 1
Cell volume: 526.2
Cell parameters: 9.1025; 8.913; 6.5273; 90; 96.442; 90;

COD ID: 7211717
CIF file	Formula: - C48 H40 F20 I10 N4 S2 - Comments: Cauliez, Pascal; Polo, Victor; Roisnel, Thierry; Llusar, Rosa; Fourmigué, Marc The thiocyanate anion as a polydentate halogen bond acceptor CrystEngComm 12(2) (2010) 558 Space group: P 1 2/a 1 Cell volume: 6680.7 Cell parameters: 16.4673; 16.426; 24.711; 90; 91.847; 90;

COD ID: 7222412
CIF file	Formula: - Li2.81 O4 Ru1.04 - Comments: Alexander, A.; Grey, C.P.; Burley, J.C.; Battle, P.D.; Gallon, D.J.; Kim Sang-Hwan Structural and magnetic properties of Li3 Ru O4 Journal of Materials Chemistry 13 (2003) 2612-2616 Space group: P 1 2/a 1 Cell volume: 143.391 Cell parameters: 5.1057; 5.8545; 5.1062; 90; 110.039; 90;

COD ID: 7228418
CIF file	Formula: - Li3 O4 Ru - Comments: Bush, T. S.; Catlow, C. R. A.; Battle, P. D. Evolutionary programming techniques for predicting inorganic crystal structures Journal of Materials Chemistry 5 (1995) 1269-1272 Space group: P 1 2/a 1 Cell volume: 143.366 Cell parameters: 5.10555; 5.85403; 5.10587; 90; 110.039; 90;

COD ID: 7229654
CIF file	Formula: - C50 H52 Br2 N2 Ni - Comments: Sun, Jinlong; Wang, Fuzhou; Li, Weimin; Chen, Min Ligand steric effects on α-diimine nickel catalyzed ethylene and 1-hexene polymerization RSC Advances 7(87) (2017) 55051 Space group: P 1 2/a 1 Cell volume: 4215 Cell parameters: 22.4157; 8.5771; 24.0509; 90; 114.281; 90;

COD ID: 7239147

Formula: - C8 H12 Cl Cu2 Gd N6 O14 -
Comments: Zou, Ji-Yong; Xu, Na; Shi, Wei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng A new family of 3d‒4f heterometallic coordination polymers assembled with 1H-1,2,3-triazole-4,5-dicarboxylic acid: syntheses, structures and magnetic properties RSC Advances 3(44) (2013) 21511
Space group: P 1 2/a 1
Cell volume: 938.5
Cell parameters: 11.6361; 6.8244; 12.1675; 90; 103.755; 90;

COD ID: 7239148

Formula: - C8 H12 Cl Cu2 N6 O14 Tb -
Comments: Zou, Ji-Yong; Xu, Na; Shi, Wei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng A new family of 3d‒4f heterometallic coordination polymers assembled with 1H-1,2,3-triazole-4,5-dicarboxylic acid: syntheses, structures and magnetic properties RSC Advances 3(44) (2013) 21511
Space group: P 1 2/a 1
Cell volume: 935.54
Cell parameters: 11.6342; 6.8158; 12.1505; 90; 103.834; 90;

COD ID: 7239149

Formula: - C8 H12 Cl Cu2 Dy N6 O14 -
Comments: Zou, Ji-Yong; Xu, Na; Shi, Wei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng A new family of 3d‒4f heterometallic coordination polymers assembled with 1H-1,2,3-triazole-4,5-dicarboxylic acid: syntheses, structures and magnetic properties RSC Advances 3(44) (2013) 21511
Space group: P 1 2/a 1
Cell volume: 921.4
Cell parameters: 11.55; 6.7557; 12.137; 90; 103.35; 90;

COD ID: 7239150

Formula: - C8 H12 Cl Cu2 Ho N6 O14 -
Comments: Zou, Ji-Yong; Xu, Na; Shi, Wei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng A new family of 3d‒4f heterometallic coordination polymers assembled with 1H-1,2,3-triazole-4,5-dicarboxylic acid: syntheses, structures and magnetic properties RSC Advances 3(44) (2013) 21511
Space group: P 1 2/a 1
Cell volume: 919
Cell parameters: 11.5691; 6.7563; 12.088; 90; 103.437; 90;

COD ID: 7239151

Formula: - C8 H12 Cl Cu2 Er N6 O14 -
Comments: Zou, Ji-Yong; Xu, Na; Shi, Wei; Gao, Hong-Ling; Cui, Jian-Zhong; Cheng, Peng A new family of 3d‒4f heterometallic coordination polymers assembled with 1H-1,2,3-triazole-4,5-dicarboxylic acid: syntheses, structures and magnetic properties RSC Advances 3(44) (2013) 21511
Space group: P 1 2/a 1
Cell volume: 921.87
Cell parameters: 11.5842; 6.772; 12.0905; 90; 103.604; 90;

COD ID: 7243524

Formula: - C34 H15 N9 -
Comments: Ripoche, Nicolas; Betou, Marie; Philippe, Clotilde; Trolez, Yann; Mongin, Olivier; Dudek, Marta; Pokladek, Ziemowit; Matczyszyn, Katarzyna; Samoc, Marek; Sahnoune, Hiba; Halet, Jean-François; Roisnel, Thierry; Toupet, Loic; Cordier, Marie; Moxey, Graeme; Humphrey, Mark G.; Paul, Frédéric Two-Photon Absorption Properties of Multipolar Triarylamino/ Tosylamido 1,1,4,4-Tetracyanobutadienes Physical Chemistry Chemical Physics (2021)
Space group: P 1 2/a 1
Cell volume: 1378.87
Cell parameters: 10.7358; 9.7979; 13.1395; 90; 93.928; 90;

COD ID: 8101575

Formula: - C10 H28 F6 N2 O6 Ta -
Comments: Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Alte da Veiga, L.; Martin-Gil, J. Crystal structure of betainium hexafluorotantalum(IV) dihydrate, (C~5~H~12~NO~2~)~2~TaF~6~ · 2H~2~O Zeitschrift für Kristallographie - New Crystal Structures 214(4) (1999) 477-478
Space group: P 1 2/a 1
Cell volume: 968.1
Cell parameters: 12.553; 6.531; 12.587; 90; 110.25; 90;

COD ID: 9000404
CIF file	Formula: - Ca Fe2 H18 Mg2 Mn O26 P4 - Comments: Moore, P. B.; Araki, T. Jahnsite, CaMnMg2(H2O)8Fe2(OH)2[PO4]4: A novel stereoisomerism of ligands about octahedral corner-chains American Mineralogist 59 (1974) 964-973 Space group: P 1 2/a 1 Cell volume: 994.353 Cell parameters: 14.94; 7.14; 9.93; 90; 110.16; 90;

COD ID: 9000546
CIF file	Formula: - Al0.55 B4 Ca2.616 Fe0.45 H2 O24 Si4 Y2.622 - Comments: Mellini, M.; Merlino, S. Hellandite: a new type of silicoborate chain American Mineralogist 62 (1977) 89-99 Space group: P 1 2/a 1 Cell volume: 858.657 Cell parameters: 18.99; 4.715; 10.3; 90; 111.4; 90;

COD ID: 9002169

Formula: - Al0.83 B4 Be0.74 Ca4.2 Ce0.66 F0.5 Fe0.65 H0.5 La0.3 Li0.24 Mg0.11 Nd0.24 O23.5 Pr0.06 Si4 Th0.36 Ti0.41 U0.06 Y0.12 -
Comments: Oberti, R.; Ottolini, L.; Camara, F.; Della Ventura, G. Crystal structure of non-metamict Th-rich hellandite-(Ce) from Latium (Italy) and crystal chemistry of the hellandite-group minerals American Mineralogist 84 (1999) 913-921
Space group: P 1 2/a 1
Cell volume: 868.041
Cell parameters: 19.068; 4.745; 10.289; 90; 111.18; 90;

COD ID: 9002729

Formula: - Al0.497 B4 Be1.18 Ca4.372 Ce0.772 Eu0.002 F0.49 Fe0.384 Gd0.006 H0.544 La0.456 Li0.026 Mg0.035 Nd0.142 O22.544 Pr0.068 Si4 Sm0.008 Th0.152 Ti0.07 U0.016 Y0.006 -
Comments: Della Ventura, G.; Bonazzi, P.; Oberti, R.; Ottolini, L. Ciprianiite and mottanaite-(Ce), two new minerals of the hellandite group from Latium (Italy) American Mineralogist 87 (2002) 739-744
Space group: P 1 2/a 1
Cell volume: 864.351
Cell parameters: 19.032; 4.746; 10.248; 90; 110.97; 90;

COD ID: 9002730

Formula: - Al0.479 B4 Be0.818 Ca4.604 Ce0.352 Dy0.002 Eu0.002 F0.49 Fe0.377 Gd0.008 H0.544 La0.09 Li0.038 Mg0.047 Mn0.016 Nd0.19 O22.544 Pr0.054 Si4 Sm0.02 Th0.628 Ti0.097 U0.034 Y0.016 -
Comments: Della Ventura, G.; Bonazzi, P.; Oberti, R.; Ottolini, L. Ciprianiite and mottanaite-(Ce), two new minerals of the hellandite group from Latium (Italy) American Mineralogist 87 (2002) 739-744
Space group: P 1 2/a 1
Cell volume: 863.993
Cell parameters: 19.059; 4.729; 10.291; 90; 111.33; 90;

COD ID: 9004055

Formula: - Al0.49 B8 Be0.54 Ca8.6 Ce1.1 F0.24 Fe0.35 H1.76 Li0.3 O37.76 Si6 Th0.3 Ti0.16 -
Comments: Boiocchi, M.; Callegari, A.; Ottolini, L. The crystal structure of piergorite-(Ce), Ca8Ce2(Al0.5Fe3+0.5)Sum1(X,Li,Be)2Si6B8O36(OH,F)2: A new borosilicate from Vetralla, Italy, with a modified hellandite-type chain American Mineralogist 91 (2006) 1170-1177
Space group: P 1 2/a 1
Cell volume: 1364.18
Cell parameters: 28.097; 4.777; 10.236; 90; 96.81; 90;

COD ID: 9004473
CIF file	Formula: - Al0.07 B4 Ca4 Ce8 Dy4 Er4 Fe0.3 Gd4 H12 La8 Mn0.04 Na2 Nd8 O38 Pr4 Si4 Sm4 Ti0.56 Y2 - Comments: Hawthorne, F. C.; Cooper, M. A.; Taylor, M. C. Refinement of the crystal structure of tadzhikite The Canadian Mineralogist 36 (1998) 817-822 Space group: P 1 2/a 1 Cell volume: 866.112 Cell parameters: 19.058; 4.729; 10.321; 90; 111.39; 90;

COD ID: 9005318

Formula: - Al4.072 Ca1.276 H4.534 K0.795 Na0.62 O31 Si7.928 -
Comments: Baur, W. H.; Joswig, W.; Fursenko, B. A.; Belitsky, I. A. Symmetry reduction of the aluminosilicate framework of LAU topology by ordering of exchangeable cations: the crystal structure of primary leonhardite with a primitive Bravais lattice European Journal of Mineralogy 9 (1997) 1173-1182
Space group: P 1 2/a 1
Cell volume: 1350.52
Cell parameters: 14.556; 13.206; 7.513; 90; 110.75; 90;

COD ID: 9008204
CIF file	Formula: - H Mn O3 Pb - Comments: Rouse, R. C. The crystal structure of quenselite Zeitschrift fur Kristallographie 134 (1971) 321-332 Space group: P 1 2/a 1 Cell volume: 292.189 Cell parameters: 5.61; 5.7; 9.15; 90; 93; 90;

COD ID: 9008304
CIF file	Formula: - Al Li O10 Si4 - Comments: Tagai, T.; Ried, H.; Joswig, W.; Korekawa, M. Kristallographische untersuchungen eines petalits mittels neutronenbeugung und transmissionselektronenmikroskopie Locality: Varutrask, Sweden Zeitschrift fur Kristallographie 160 (1982) 159-170 Space group: P 1 2/a 1 Cell volume: 427.706 Cell parameters: 11.737; 5.171; 7.63; 90; 112.54; 90;

COD ID: 9008439
CIF file	Formula: - Ca6 O19 Si6 - Comments: Hejny, C.; Armbruster, T. Polytypism in xonotlite Ca6Si6O17(OH)2 Note: polytype derived from structure in Kudoh and Takeuchi (1979) Zeitschrift fur Kristallographie 216 (2001) 396-408 Space group: P 1 2/a 1 Cell volume: 879.334 Cell parameters: 17.032; 7.363; 7.012; 90; 90.36; 90;

COD ID: 9010455
CIF file	Formula: - Fe3 H18 Mg2 Na O26 P4 - Comments: Kampf, A. R.; Steele, I. M.; Loomis, T. A. Jahnsite-(NaFeMg), a new mineral from the Tip Top mine, Custer County, South Dakota: Description and crystal structure American Mineralogist 93 (2008) 940-945 Space group: P 1 2/a 1 Cell volume: 991.841 Cell parameters: 15.0811; 7.1403; 9.8299; 90; 110.445; 90;

COD ID: 9011071
CIF file	Formula: - O4 Ta Y - Comments: Wolten, G. M. The structure of the M'-phase of YTaO4, a third fergusonite polymorph Acta Crystallographica 23 (1967) 939-944 Space group: P 1 2/a 1 Cell volume: 146.476 Cell parameters: 5.292; 5.451; 5.11; 90; 96.44; 90;

COD ID: 9011903
CIF file	Formula: - Al0.26 B4 Ca4 Ce2 Fe0.34 O24 Si4 Ti0.4 - Comments: Chernitsova, N. M.; Pudovkina, Z. V.; Pyatenko, Y. A. About the crystal structure of tadzhikite {(Ca,Tr)4(Y,Tr)2(Ti,Fe,Al)(O,OH)2 [Si4B4O22]} Soviet Physics Doklady 27 (1982) 367-368 Space group: P 1 2/a 1 Cell volume: 855.593 Cell parameters: 18.946; 4.714; 10.302; 90; 111.58; 90;

COD ID: 9011922
CIF file	Formula: - B2 Ca H12 O10 - Comments: Simonov, M. A.; Yamnova, N. A.; Kazanskaya, E. V.; Egorov-Tismenko Yu K; Belov, N. V. Crystal structure of Ca(B(OH)4)2(H2O)2 Note: Data is transformed from 1st setting to 2nd setting Doklady Akademii Nauk SSSR 228 (1976) 1337-1340 Space group: P 1 2/a 1 Cell volume: 413.444 Cell parameters: 8.006; 6.649; 8.012; 90; 104.21; 90;

COD ID: 9012396
CIF file	Formula: - Be1.694 Ca1.9 Fe2.449 H2 K0.072 Mg2.551 Na0.1 O24 Pb0.928 Si6.306 - Comments: Moore, P. B.; Davis, A. M.; Van Derveer, D. G.; Sen Gutpa, P. K. Joesmithite, a plumbous amphibole revisited and comments on bond valences Mineralogy and Petrology 48 (1993) 97-113 Space group: P 1 2/a 1 Cell volume: 897.246 Cell parameters: 9.915; 17.951; 5.243; 90; 105.95; 90;

COD ID: 9014600

Formula: - Al1.76 Ca Fe1.95 H18 Mg0.29 Mn O26 P4 -
Comments: Grey, I. E.; Mumme, W. G.; Neville, S. M.; Wilson, N. C.; Birch, W. D. Jahnsite - whiteite solid solutions and associated minerals in the phosphate pegmatite at Hagendorf-Sud, Bavaria, Germany Mineralogical Magazine 74 (2010) 969-978
Space group: P 1 2/a 1
Cell volume: 974.594
Cell parameters: 14.941; 6.9495; 10.054; 90; 111; 90;

COD ID: 9015830

Formula: - Al1.84 Ca0.93 Fe0.16 H18 Mg0.04 Mn2.96 O26 P4 Zn0.07 -
Comments: Yakovenchuk, V. N.; Keck, E.; Krivovichev, S. V.; Pakhomovsky, Y. A.; Selivanova, E. A.; Mikhailova, J. A.; Chernyatieva, A. P.; Ivanyuk, G. Y. Whiteite-(CaMnMn), CaMnMn2Al2[PO4]4(OH)2*8H2O, a new mineral from the Hagendorf-Sud granitic pegmatite, Germany Mineralogical Magazine 76 (2012) 2761-2771
Space group: P 1 2/a 1
Cell volume: 984.199
Cell parameters: 15.02; 6.959; 10.137; 90; 111.74; 90;

COD ID: 9016502
CIF file	Formula: - Al2 Ca0.95 Fe0.9 H18 Mg2 Na0.11 O26 P4 - Comments: Capitelli, F.; Chita, G.; Cavallo, A.; Bellatreccia, F.; Ventura, G. Crystal structure of whiteite-(CaFeMg) from Crosscut Creek, Canada Zeitschrift fur Kristallographie 226 (2011) 731-738 Space group: P 1 2/a 1 Cell volume: 967.306 Cell parameters: 14.87; 6.9785; 9.9268; 90; 110.11; 90;

COD ID: 9017202

Formula: - Al0.92 B4 Ca1.582 Fe0.08 H2 Mn0.88 O24 Si4 Y2.752 Yb0.386 -
Comments: Miyawaki, R.; Momma, K.; Yokoyama, K.; Shigeoka, M.; Matsubara, S.; Ito, M.; Nakai, I.; Kristiansen, R. Mn-bearing hellandite-(Y) from the Heftetjern pegmatite, Tordal, Norway The Canadian Mineralogist 53 (2015) 345-356
Space group: P 1 2/a 1
Cell volume: 813.371
Cell parameters: 18.609; 4.6307; 10.143; 90; 111.475; 90;

COD ID: 9017203

Formula: - Al0.164 Ca0.277 Fe2.454 H18 Mg1.545 Mn0.961 Na0.569 O26 P4 -
Comments: Kampf, A. R.; Elliott, P.; Nash, B. P.; Chiappino, L.; Varvello, S. Jahnsite-(NaMnMg), a new jahnsite-group mineral from the Sapucaia mine, Brazil and the White Rock No. 2 quarry, Australia The Canadian Mineralogist 56 (2018) 871-882
Space group: P 1 2/a 1
Cell volume: 1001.84
Cell parameters: 15.1045; 7.1629; 9.8949; 90; 110.64; 90;

COD ID: 9017204

Formula: - Al1.82 Ca0.39 H16 K0.01 Mg2.08 Mn1.66 Na0.03 O26 P4 -
Comments: Elliott, P.; Willis, A. C. Whiteite-(MnMnMg), a new jahnsite-group mineral from Iron Monarch, South Australia: Description and crystal structure Note: Not all hydrogens were located The Canadian Mineralogist 57 (2019) 215-223
Space group: P 1 2/a 1
Cell volume: 969.857
Cell parameters: 15.0357; 6.9408; 9.9431; 90; 110.827; 90;

COD ID: 9017205

Formula: - Ca0.25 Fe4 H18 Mn1.4 Na0.05 O26 P4 -
Comments: Vignola, P.; Hatert, F.; Rotiroti, N.; Nestola, F.; Risplendente, A.; Vanini, F. Jahnsite-(MnMnFe), Mn2+Mn2+Fe22+Fe23+(PO4)4(OH)2*8H2O, a new phosphate mineral from the Malpensata pegmatite, Olgiasca, Colico municipality, Lecco province, Italy The Canadian Mineralogist 57 (2019) 225-233
Space group: P 1 2/a 1
Cell volume: 1006.11
Cell parameters: 15.1559; 7.1478; 10.0209; 90; 112.059; 90;

COD ID: 9017206

Formula: - Al0.36 Ca0.25 Fe1.85 H22 Mg1.26 Mn2.02 Na0.2 O26 P4 -
Comments: Vignola, P.; Hatert, F.; Baijot, M.; Rotiroti, N.; Risplendente, A.; Varvello, S. Jahnsite-(MnMnMg), Mn2+Mn2+Mg2+2Fe3+2(PO4)4(OH)2*8H2O, a new phosphate mineral species from Sapucaia pegmatite, Sapucaia Do Norte, Galileia, Minas Gerais, Brazil The Canadian Mineralogist 57 (2019) 363-370
Space group: P 1 2/a 1
Cell volume: 1017.31
Cell parameters: 15.177; 7.176; 10.006; 90; 111.01; 90;

COD ID: 9017254
CIF file	Formula: - Al0.01 Ca0.7 Fe3.23 H18 Mg1.33 Mn0.59 Na0.17 O26 P4 - Comments: Elliott, P. Jahnsite-(CaFeMg), a new mineral from Tom's quarry, South Australia: description and crystal structure European Journal of Mineralogy 28 (2016) 991-996 Space group: P 1 2/a 1 Cell volume: 996.725 Cell parameters: 14.975; 7.1645; 9.928; 90; 110.65; 90;

COD ID: 9017261

Formula: - Fe3.85 H8.74 Mn3 O24.08 P4 -
Comments: Sejkora, J.; Grey, I. E.; Kampf, A. R. Kenngottite, Mn32+Fe43+(PO4)4(OH)6(H2O)2: a new phosphate mineral from Krasno near Horni Slavkov, Czech Republic Note: water and hydroxyl groups are not well located European Journal of Mineralogy 31 (2019) 629-636
Space group: P 1 2/a 1
Cell volume: 866.541
Cell parameters: 13.909; 5.186; 12.159; 90; 98.88; 90;

COD ID: 9017673