Search results

Formula: - C38.31 H83.64 Ga9 -
Comments: Uhl, Werner; Cuypers, Lars; Harms, Klaus; Kaim, Wolfgang; Wanner, Matthias; Winter, Rainer; Koch, Rainer; Saak, Wolfgang Ga~9~(CMe~3~)~9~, an Important New Building Block in the Structural Chemistry of the Alkylelement(I) Compounds EnRn (E=B-In) Zeitschrift für Anorganische und Allgemeine Chemie 40(3) (2001) 566-568
Space group: P n n m
Cell volume: 15555.5
Cell parameters: 19.0073; 21.8155; 37.5145; 90; 90; 90;

COD ID: 1100911
CIF file	Formula: - C5 D4 Fe N6 Na2 O3 - Comments: Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N. Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction Acta Crystallographica, Section C 56 (2000) 1289-1291 Space group: P n n m Cell volume: 1152.5 Cell parameters: 6.207; 11.915; 15.583; 90; 90; 90;

COD ID: 1100912
CIF file	Formula: - C5 D4 Fe N6 Na2 O3 - Comments: Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N. Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction Acta Crystallographica, Section C 56 (2000) 1289-1291 Space group: P n n m Cell volume: 1127 Cell parameters: 6.124; 11.837; 15.547; 90; 90; 90;

COD ID: 1100913
CIF file	Formula: - C5 H1.1 D2.9 Fe N6 Na2 O3 - Comments: Schultz, Arthur J.; Figgis, Brian N.; Sobolev, Alexandre N. Na~2~Fe(CN)~5~NO.2D~2~O at 11 and 293 K by X-ray and at 15 K by neutron diffraction Acta Crystallographica, Section C 56 (2000) 1289-1291 Space group: P n n m Cell volume: 1127 Cell parameters: 6.124; 11.837; 15.547; 90; 90; 90;

COD ID: 1507776
CIF file	Formula: - Nb4 O17 Sr5 Ti - Comments: Drews, A R; Wong-Ng, W; Roth, R S; Vanderah, T A PREPARATION AND CRYSTAL STRUCTURE OF Sr5TiNb4O17 Materials Research Bulletin 31 (1996) 153-163 Space group: P n n m Cell volume: 727.58 Cell parameters: 5.6614; 32.515; 3.9525; 90; 90; 90;

COD ID: 1509094

Formula: - Ag0.32 Bi19.6 Cu2.96 Fe0.72 Pb51.2 S114 Sb21.2 -
Comments: Makovicky, E.; Mumme, W.G. The crystal structure of izoklakeite, Pb51.3 Sb20.4 Bi19.5 Ag1.2 Cu2.9 Fe0.7 S114 The kobellite homologous series and its derivatives Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-) 153 (1986) 121-145
Space group: P n n m
Cell volume: 5269.08
Cell parameters: 34.07; 37.98; 4.072; 90; 90; 90;

COD ID: 1510201
CIF file	Formula: - Au K Na2 O2 - Comments: Hoppe, R.; Wagner, G. Das erste Oxoaurat(I) mit (O-Au-O)-Hanteln: K Na2 (Au O2) Zeitschrift fuer Anorganische und Allgemeine Chemie 537 (1986) 115-122 Space group: P n n m Cell volume: 224.483 Cell parameters: 10.256; 5.472; 4; 90; 90; 90;

COD ID: 1510249
CIF file	Formula: - Au Na2 O2 Rb - Comments: Mudring, A.V.; Jansen, M. Synthese, Kristallstruktur und Eigenschaften von Na2 Rb Au O2 Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 135-138 Space group: P n n m Cell volume: 226.788 Cell parameters: 9.9276; 5.5903; 4.0864; 90; 90; 90;

COD ID: 1510720
CIF file	Formula: - B2 Ir Mo2 - Comments: Nowotny, H.; Rogl, P.; Benesovsky, F. Ueber einige Komplexboride mit Platinmetallen Monatshefte fuer Chemie (-108,1977) 103 (1972) 965-989 Space group: P n n m Cell volume: 223.935 Cell parameters: 9.422; 7.356; 3.231; 90; 90; 90;

COD ID: 1510819
CIF file	Formula: - B2 Ru1.25 W1.75 - Comments: Rogl, P.; Nowotny, H. Neue Phasen mit Mo2 Ir B2-Typ Revue de Chimie Minerale 11 (1974) 547-555 Space group: P n n m Cell volume: 219.494 Cell parameters: 9.579; 7.459; 3.072; 90; 90; 90;

COD ID: 1510830
CIF file	Formula: - B2 Ca Li4 O6 - Comments: Cao, Y.G.; Li, X.Z.; Wang, C.; Xu, Y.P.; Wu, L.; Chen, X.L. Ab initio structure determination of new compound Li4 Ca B2 O6 Journal of Solid State Chemistry 177 (2004) 1847-1851 Space group: P n n m Cell volume: 260.422 Cell parameters: 9.24036; 8.09482; 3.48162; 90; 90; 90;

COD ID: 1511294
CIF file	Formula: - B Pd2 - Comments: Tergenius, L.E.; Lundstroem, T. The crystal structure of Pd2 B Journal of Solid State Chemistry 31 (1980) 361-367 Space group: P n n m Cell volume: 74.802 Cell parameters: 4.6918; 5.1271; 3.1096; 90; 90; 90;

COD ID: 1511563
CIF file	Formula: - B5.82 Si1.04 - Comments: Garbauskas, M.F.; Slack, G.A.; Viala, J.C.; Kasper, J.S.; Vlasse, M. The crystal structure of Si B6 Journal of Solid State Chemistry 63 (1986) 31-45 Space group: P n n m Cell volume: 2613.77 Cell parameters: 14.397; 18.318; 9.911; 90; 90; 90;

COD ID: 1512396

Formula: - B4 Fe -
Comments: Gou, Huiyang; Dubrovinskaia, Natalia; Bykova, Elena; Tsirlin, Alexander A.; Kasinathan, Deepa; Schelle, Walter; Richter, Asta; Merlini, Marco; Hanfland, Michael; Abakumov, Artem M.; Batuk, Dmitry; van Tendeloo, Gustaaf; Nakajima, Yoichi; Kolmogorov, Aleksey N.; Dubrovinsky, Leonid Discovery of a superhard iron tetraboride superconductor Physical Review Letters 111(15) (2013)
Space group: P n n m
Cell volume: 72.752
Cell parameters: 4.5786; 5.2981; 2.9991; 90; 90; 90;

COD ID: 1512486
CIF file	Formula: - Mn2 O5 Sr2 - Comments: Takanori Mori; Kazuko Inoue; Naoki Kamegashira; Yasuo Yamaguchi; Kenji Ohoyama Neutron diffraction study of Sr2Mn2O5 Journal of Alloys and Compounds 296(1--2) (2000) 92-97 Space group: P n n m Cell volume: 448.43 Cell parameters: 5.499; 10.73; 7.6; 90; 90; 90;

COD ID: 1514090
CIF file	Formula: - Li O2 - Comments: Zhuravlev, Yu. N.; Obolonskaya, O. S. Structure, mechanical stability and chemical bond in alkali metal oxides Journal of Structural Chemistry (USSR) (= Zhurnal Strukturnoi Khimii) 51(6) (2010) 1005-1013 Space group: P n n m Cell volume: 57.648 Cell parameters: 3.992; 4.877; 2.961; 90; 90; 90;

COD ID: 1515265

Formula: - C79 H85 Cl8 N5 S16 -
Comments: Park, Jung Su; Bejger, Christopher; Larsen, Karina R.; Nielsen, Kent A.; Jana, Atanu; Lynch, Vincent M.; Jeppesen, Jan O.; Kim, Dongho; Sessler, Jonathan L. Synthesis and recognition properties of higher order tetrathiafulvalene (TTF) calix[n]pyrroles (n = 4‒6) Chemical Science 3(9) (2012) 2685
Space group: P n n m
Cell volume: 9141
Cell parameters: 29.858; 14.168; 21.609; 90; 90; 90;

COD ID: 1516395

Formula: - C6 H6 Eu O9 -
Comments: Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S. Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks. The journal of physical chemistry. B 113(36) (2009) 12181-12188
Space group: P n n m
Cell volume: 902.75
Cell parameters: 13.4361; 6.625; 10.1416; 90; 90; 90;

COD ID: 1516396

Formula: - C6 H6 Gd O9 -
Comments: Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S. Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks. The journal of physical chemistry. B 113(36) (2009) 12181-12188
Space group: P n n m
Cell volume: 890
Cell parameters: 13.3662; 6.5897; 10.1045; 90; 90; 90;

COD ID: 1516397

Formula: - C6 H6 O9 Tb -
Comments: Rodrigues, Marcelo O.; Paz, Filipe A Almeida; Freire, Ricardo O.; de Sá, Gilberto F; Galembeck, André; Montenegro, Maria C. B. S. M.; Araújo, Alberto N; Alves, S. Modeling, structural, and spectroscopic studies of lanthanide-organic frameworks. The journal of physical chemistry. B 113(36) (2009) 12181-12188
Space group: P n n m
Cell volume: 884.74
Cell parameters: 13.341; 6.5718; 10.0912; 90; 90; 90;

COD ID: 1519783
CIF file	Formula: - C14 H20 Co N2 O4 P2 S4 - Comments: Devillanova, Francesco; Aragoni, Carla; Arca, Massimiliano; Hursthouse, Michael B.; Huth, Susanne L. C14H20Co1N2O4P2S4 Crystal Structure Report Archive (2006) 237 Space group: P n n m Cell volume: 1074.93 Cell parameters: 11.3361; 11.3717; 8.3386; 90; 90; 90;

COD ID: 1519988
CIF file	Formula: - C5 H10 Cl4 N3 O2 P3 - Comments: Coles, Simon J.; Hursthouse, Michael B.; Davies, David B.; Kilic, A.; Uslu, A. C5H10Cl4N3O2P3 Crystal Structure Report Archive (2008) 483 Space group: P n n m Cell volume: 1430.35 Cell parameters: 11.539; 12.4271; 9.9748; 90; 90; 90;

COD ID: 1520983
CIF file	Formula: - Fe Sb2 - Comments: Chumak, I.V.; Pavlyuk, V.V.; Dmytriv, G.S.; Stepien-Damm, Yu. Phase equilibria and crystal structure of compounds in the Fe - Zn - Sb system at 570 K Journal of Alloys Compd. 307 (2000) 223-225 Space group: P n n m Cell volume: 121.319 Cell parameters: 5.823; 6.523; 3.194; 90; 90; 90;

COD ID: 1521189
CIF file	Formula: - Cu2.5 Gd2 Rb1.5 Se5 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5 Journal of Solid State Chemistry 151 (2000) 317-322 Space group: P n n m Cell volume: 1094.91 Cell parameters: 16.243; 16.449; 4.098; 90; 90; 90;

COD ID: 1521191
CIF file	Formula: - Cu2.5 Dy2 Rb1.5 Se5 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the new quaternary rubidium selenides Rb Ln2 Cu Se4 (Ln = Sm, Gd, Dy), Rb1.5 Ln2 Cu2.5 Se5 (Ln = Gd, Dy),and Rb Sm2 Ag3 Se5 Journal of Solid State Chemistry 151 (2000) 317-322 Space group: P n n m Cell volume: 1066.53 Cell parameters: 16.12; 16.292; 4.061; 90; 90; 90;

COD ID: 1521526
CIF file	Formula: - O3 Pb Ti0.03 Zr0.97 - Comments: Liu, H.-C.; Toraya, H. Ab initio structural study on Nb-doped Pb (Zr0.97 Ti0.03) O3 ceramic material by synchrotron X-ray diffraction Japanese Journal of Applied Physics, Part 1 38 (1999) 104-107 Space group: P n n m Cell volume: 564.893 Cell parameters: 5.86295; 11.74014; 8.20686; 90; 90; 90;

COD ID: 1523082
CIF file	Formula: - O4 W - Comments: Wilhelmi, K.A.; Waltersson, K.; Loefgren, P. On the structure of a high pressure polymorph of lithium wolframate(VI). Li2 W O4 (III). Crystal Structure Communications 6 (1977) 219-223 Space group: P n n m Cell volume: 596.414 Cell parameters: 5.063; 10.076; 11.691; 90; 90; 90;

COD ID: 1524072
CIF file	Formula: - Pt2 Sb2.6 Sn2.6 - Comments: Bhan, S.; Goedecke, T.; Schubert, K. Konstitution einiger Mischungen des Platins mit B-Elementen (B = Sn, Sb, Te) Journal of the Less-Common Metals 19 (1969) 121-121 Space group: P n n m Cell volume: 138.739 Cell parameters: 6.62; 5.36; 3.91; 90; 90; 90;

COD ID: 1524634
CIF file	Formula: - Ce2 Cu9 In3 - Comments: Kal'ichak, Ya.M.; Baranyak, V.M.; Dmytrakh, O.V.; Bel'skii, V.K. Crystal structure of Ce Cu4.38 In1.62, compound and affinative compounds Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya B: Geologichni, Khimichni ta Biologichni Nauki 1988 (1988) 39-42 Space group: P n n m Cell volume: 974.228 Cell parameters: 17.169; 10.908; 5.202; 90; 90; 90;

COD ID: 1524663

Formula: - Cu2 H O5 P -
Comments: Keller, P.; Hess, H.; Zettler, F. Ladungsbilanzen an den verfeinerten Kristallstrukturen von Libethenit, Adamin und Co2 ((O H)/As O4) und ihre Wasserstoffbrueckenbindungen Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-) 134 (1979) 147-156
Space group: P n n m
Cell volume: 400.444
Cell parameters: 8.076; 8.407; 5.898; 90; 90; 90;

COD ID: 1524664

Formula: - As Co2 H O5 -
Comments: Keller, P.; Zettler, F.; Hess, H. Ladungsbilanzen an den verfeinerten Kristallstrukturen von libethenit, Adamin und Co2 ((O H)/As O4) und ihre Wasserstoffbrueckenbindungen Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-) 134 (1979) 147-156
Space group: P n n m
Cell volume: 430.891
Cell parameters: 8.286; 8.594; 6.051; 90; 90; 90;

COD ID: 1525870
CIF file	Formula: - Cu4 Nd P2 - Comments: Demchyna, R.O.; Orishchin, S.V.; Kuz'ma, Yu.B. The Nd - Cu - P system Journal of Alloys Compd. 322 (2001) 176-183 Space group: P n n m Cell volume: 630.421 Cell parameters: 14.6746; 11.0027; 3.9045; 90; 90; 90;

COD ID: 1526043
CIF file	Formula: - Bi12 Cl14 - Comments: Friedman, R.M.; Corbett, J.D. On the synthesis and crystal structure of dodecabismuth tetradecachloride, Bi12 Cl14 Inorganica Chimica Acta 7 (1973) 525-527 Space group: P n n m Cell volume: 3033.54 Cell parameters: 23.067; 14.992; 8.772; 90; 90; 90;

COD ID: 1526213
CIF file	Formula: - Cl5 Nb3 O2 - Comments: Gulo, F.; Perrin, C. The crystal structure of Nb3 O2 Cl5, an original Nb3 cluster oxyhalide Materials Research Bulletin 35 (2000) 253-262 Space group: P n n m Cell volume: 782.229 Cell parameters: 8.06; 14.496; 6.695; 90; 90; 90;

COD ID: 1526373
CIF file	Formula: - Cu5 K3 Sm4 Te10 - Comments: Huang Fuqiang; Ibers, J.A. Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5 Te10 Journal of Solid State Chemistry 160 (2001) 409-414 Space group: P n n m Cell volume: 1290.59 Cell parameters: 16.59; 17.877; 4.3516; 90; 90; 90;

COD ID: 1526376
CIF file	Formula: - Bi5 Cu2 K3 S10 - Comments: Huang, F.Q.; Mitchell, K.; Ibers, J.A. Syntheses and structures of the quaternary alkali-metal bismuth coinage-metal chalcogenides K3 Bi5 Cu2 S10, Cs Bi2 Cu S4, Rb Bi2.66 Cu Se5 and Cs Bi Ag2 S3 Journal of Alloys Compd. 325 (2001) 84-90 Space group: P n n m Cell volume: 1011.96 Cell parameters: 14.173; 17.69; 4.0362; 90; 90; 90;

COD ID: 1526392
CIF file	Formula: - Cu5 Gd4 K3 Te10 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5 Te10 Journal of Solid State Chemistry 160 (2001) 409-414 Space group: P n n m Cell volume: 1273.19 Cell parameters: 16.552; 17.767; 4.3294; 90; 90; 90;

COD ID: 1526393
CIF file	Formula: - Cu5 Er4 K3 Te10 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5 Te10 Journal of Solid State Chemistry 160 (2001) 409-414 Space group: P n n m Cell volume: 1240.02 Cell parameters: 16.46; 17.55; 4.2926; 90; 90; 90;

COD ID: 1526394
CIF file	Formula: - Cu5 Nd4 Rb3 Te10 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5 Te10 Journal of Solid State Chemistry 160 (2001) 409-414 Space group: P n n m Cell volume: 1355 Cell parameters: 17.356; 17.82; 4.3811; 90; 90; 90;

COD ID: 1526396
CIF file	Formula: - Cu5 Gd4 Rb3 Te10 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5 Te10 Journal of Solid State Chemistry 160 (2001) 409-414 Space group: P n n m Cell volume: 1313.71 Cell parameters: 17.201; 17.586; 4.3429; 90; 90; 90;

COD ID: 1526397
CIF file	Formula: - Cs3 Cu5 Gd4 Te10 - Comments: Huang, F.Q.; Ibers, J.A. Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5 Te10 Journal of Solid State Chemistry 160 (2001) 409-414 Space group: P n n m Cell volume: 1359.34 Cell parameters: 17.512; 17.764; 4.3697; 90; 90; 90;

COD ID: 1526642
CIF file	Formula: - Al11.5 K11.5 O64 Si20.5 - Comments: Skofteland, B.M.; Ellestad, O.H.; Lillerud, K.P. Potassium merlinoite: crystallization, structural and thermal properties Microporous and Mesoporous Materials 43 (2001) 61-71 Space group: P n n m Cell volume: 1762.79 Cell parameters: 9.79696; 13.416; 13.4118; 90; 90; 90;

COD ID: 1526680

Formula: - C4 Mn N6 -
Comments: Kmety, C.R.; Huang, Q.-Z.; Lynn, J.W.; McCall, S.; Manson, J.L.; Epstein, A.J.; Crow, J.E.; Erwin, R.W.; Stevenson, K.L.; Miller, J.S. Noncollinear antiferromagnetic structure of the molecule-based magnet Mn (N (C N)2)2 Physical Review, Serie 3. B - Condensed Matter (18,1978-) 62 (2000) 5576-5588
Space group: P n n m
Cell volume: 339.019
Cell parameters: 6.1486; 7.3155; 7.5371; 90; 90; 90;

COD ID: 1526921
CIF file	Formula: - Nb28 Ni33.56 Sb12.44 - Comments: Wang, M.; Mar, A. Nb28 Ni33.5 Sb12.5, a new representative of the X-phase Journal of Solid State Chemistry 160 (2001) 450-459 Space group: P n n m Cell volume: 1099.55 Cell parameters: 13.2334; 16.5065; 5.0337; 90; 90; 90;

COD ID: 1527008
CIF file	Formula: - Bi5 Cu2 Rb3 S10 - Comments: Yang, Y.-T.; Brazis, P.; Ibers, J.A.; Kannewurf, C.R. Structures and conductivities of the quaternary A/Bi/Cu/S phases K Bi2 Cu S4 and A3 Bi5 Cu2 S10 (A = Rb, Cs) Journal of Solid State Chemistry 155 (2000) 243-249 Space group: P n n m Cell volume: 1056.37 Cell parameters: 14.571; 17.8189; 4.0686; 90; 90; 90;

COD ID: 1527009
CIF file	Formula: - Bi5 Cs3 Cu2 S10 - Comments: Yang, Y.-T.; Brazis, P.; Kannewurf, C.R.; Ibers, J.A. Structures and conductivities of the quaternary A/Bi/Cu/S phases K Bi2 Cu S4 and A3 Bi5 Cu2 S10 (A = Rb, Cs) Journal of Solid State Chemistry 155 (2000) 243-249 Space group: P n n m Cell volume: 1108.93 Cell parameters: 15.041; 17.994; 4.0973; 90; 90; 90;

COD ID: 1527578
CIF file	Formula: - H14 K N7 Sm2 - Comments: Jacobs, H.; Kistrup, H. Ueber das System Kalium/Samarium/Ammoniak Zeitschrift fuer Anorganische und Allgemeine Chemie 435 (1977) 127-136 Space group: P n n m Cell volume: 1048.27 Cell parameters: 6.654; 10.06; 15.66; 90; 90; 90;

COD ID: 1527620
CIF file	Formula: - H18 I6 O8 Te - Comments: Katryniok, D.; Mootz, D.; Kniep, R. Zur Kenntnis der Verbindung H2 Te I6 (H2 O)8 Zeitschrift fuer Anorganische und Allgemeine Chemie 461 (1980) 96-100 Space group: P n n m Cell volume: 1141.56 Cell parameters: 12.672; 10.825; 8.322; 90; 90; 90;

COD ID: 1527688
CIF file	Formula: - Cl16 Ti7 - Comments: Krebs, B.; Henkel, G. Die Kristallstruktur von Ti7 Cl16 und Ti7 Br16: Verbindungen mit trigonalen Ti3-Clustern Zeitschrift fuer Anorganische und Allgemeine Chemie 474 (1981) 149-156 Space group: P n n m Cell volume: 992.315 Cell parameters: 14.421; 9.987; 6.89; 90; 90; 90;

COD ID: 1527689
CIF file	Formula: - Br16 Ti7 - Comments: Krebs, B.; Henkel, G. Die Kristallstruktur von Ti7 Cl16 und Ti7 Br16: Verbindungen mit trigonalen Ti3-Clustern Zeitschrift fuer Anorganische und Allgemeine Chemie 474 (1981) 149-156 Space group: P n n m Cell volume: 1171.92 Cell parameters: 15.228; 10.577; 7.276; 90; 90; 90;

COD ID: 1528156
CIF file	Formula: - C5 H7 Fe N6 Na2 O2 - Comments: Tullberg, A.; Vannerberg, N.G. The crystal structure of Na2 Fe (C N)5 N H3 (H2 O)2 Acta Chemica Scandinavica (1-27,1973-42,1988) 26 (1972) 3382-3383 Space group: P n n m Cell volume: 1125.15 Cell parameters: 6.1; 11.9; 15.5; 90; 90; 90;

COD ID: 1528172
CIF file	Formula: - Cu2 H O5 P - Comments: Walitzi, E.M. Strukturverfeinerung von Libethenit Cu2 (O H) (P O4) Tschermaks Mineralogische und Petrographische Mitteilungen (-1978) 8 (1963) 614-624 Space group: P n n m Cell volume: 406.655 Cell parameters: 8.11; 8.47; 5.92; 90; 90; 90;

COD ID: 1528256
CIF file	Formula: - Ru Te2 - Comments: Zhao, H.; Schils, H.W.; Raub, C.J. Untersuchungen im System Ruthenium-Selen-Tellur Journal of the Less-Common Metals 113 (1985) 75-82 Space group: P n n m Cell volume: 135.953 Cell parameters: 5.2915; 6.4043; 4.0118; 90; 90; 90;

COD ID: 1528273
CIF file	Formula: - Bi Br1.167 - Comments: von Benda, H.; Simon, A.; Bauhofer, W. Zur Kenntnis von Bi Br und Bi Br1.167 Zeitschrift fuer Anorganische und Allgemeine Chemie 438 (1978) 53-67 Space group: P n n m Cell volume: 3405.34 Cell parameters: 23.852; 15.622; 9.139; 90; 90; 90;

COD ID: 1528383
CIF file	Formula: - As2 Mo0.4 - Comments: Brown, A. Structure data for some Arsenic- and Germanium-rich Compounds of Molybdenum Nature (London) 206 (1965) 502-503 Space group: P n n m Cell volume: 91.466 Cell parameters: 5.299; 5.983; 2.885; 90; 90; 90;

COD ID: 1528607
CIF file	Formula: - Gd3.04 S6 Sc0.96 - Comments: Jin Gengbang; Choi Eunsang; Albrecht-Schmitt, T.E. Syntheses, structures, magnetism, and optical properties of gadolinium scandium chalcogenides Journal of Solid State Chemistry 182 (2009) 1075-1081 Space group: P n n m Cell volume: 846.951 Cell parameters: 13.5488; 16.3057; 3.8337; 90; 90; 90;

COD ID: 1528652
CIF file	Formula: - C2 H2 Co N4 - Comments: Krott, M.; Liu Xiaohui; Mueller, P.; Dronskowski, R. Synthesis and structure determination of Co (H N C N)2 and Ni (H N C N)2 Journal of Solid State Chemistry 180 (2007) 307-312 Space group: P n n m Cell volume: 189.05 Cell parameters: 6.572; 8.805; 3.267; 90; 90; 90;

COD ID: 1528653
CIF file	Formula: - C2 H2 N4 Ni - Comments: Krott, M.; Mueller, P.; Liu Xiaohui; Dronskowski, R. Synthesis and structure determination of Co (H N C N)2 and Ni (H N C N)2 Journal of Solid State Chemistry 180 (2007) 307-312 Space group: P n n m Cell volume: 182.866 Cell parameters: 6.457; 8.768; 3.23; 90; 90; 90;

COD ID: 1530586
CIF file	Formula: - K5 O20 P2 Sb5 - Comments: Piffard, Y.; Lachgar, A.; Tournoux, M. A potassium phosphatoantimonate with a three dimensional framework K5 Sb5 P2 O20 Materials Research Bulletin 21 (1986) 1231-1238 Space group: P n n m Cell volume: 3092.45 Cell parameters: 23.443; 18.452; 7.149; 90; 90; 90;

COD ID: 1530633
CIF file	Formula: - O2 Pt - Comments: Range, K.J.; Klement, U.; Rau, F.; Heyns, A.M. beta-Pt O2: High pressure synthesis of single crystals and structure refinement Materials Research Bulletin 22 (1987) 1541-1547 Space group: P n n m Cell volume: 63.818 Cell parameters: 4.4839; 4.5385; 3.136; 90; 90; 90;

COD ID: 1531302

Formula: - C60 -
Comments: Dilanyan, R.A.; Khasanov, S.S.; Gurov, A.F.; Osip'yan, Yu.A.; Bredikhin, S.I.; Kveder, V.V.; Shalynin, A.I. Phase transitions and the structure of the C60 crystal doped with lithium by electrodiffusion Zhurnal Eksperimental'noi i Teoreticheskoi Fiziki 93 (2001) 1430-1437
Space group: P n n m
Cell volume: 1319.57
Cell parameters: 14.745; 9.843; 9.092; 90; 90; 90;

COD ID: 1531816
CIF file	Formula: - Er7 K3 S12 - Comments: Lissner, F.; Schleid, T.; Hartenbach, I. K3 Er7 S12 und Rb3 Er7 S12: zwei ternaere Erbium(III)-Sulfide mit Kanalstruktur Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1552-1555 Space group: P n n m Cell volume: 1148.42 Cell parameters: 11.8538; 24.615; 3.9359; 90; 90; 90;

COD ID: 1531818
CIF file	Formula: - Er7 Rb3 S12 - Comments: Lissner, F.; Hartenbach, I.; Schleid, T. K3 Er7 S12 und Rb3 Er7 S12: zwei ternaere Erbium(III)-Sulfide mit Kanalstruktur Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1552-1555 Space group: P n n m Cell volume: 1179.94 Cell parameters: 12.0351; 24.83; 3.9485; 90; 90; 90;

COD ID: 1531936
CIF file	Formula: - H4 Mn4 N O12 P3 - Comments: Neeraj, S.; Noy, M.L.; Cheetham, A.K. Structure and magnetic properties of a three-dimensional framework manganese(II) phosphate, (N H4) (Mn4 (P O4)3) Solid State Sciences 4 (2002) 397-404 Space group: P n n m Cell volume: 1070 Cell parameters: 9.8856; 16.745; 6.4639; 90; 90; 90;

COD ID: 1532077

Formula: - Ce3 F3 O S2 -
Comments: Pauwels, D.; Demourgues, A.; Guillen, F.; Laronze, H.; Gravereau, P.; Tressaud, A.; Isnard, O. Structural features of new rare earth-based mixed anions (O, S, F) compounds: relationships between optical absorption and rare earth environment Solid State Sciences 4 (2002) 1471-1479
Space group: P n n m
Cell volume: 637.55
Cell parameters: 5.743; 5.725; 19.391; 90; 90; 90;

COD ID: 1532079

Formula: - F3 La3 O S2 -
Comments: Pauwels, D.; Demourgues, A.; Isnard, O.; Tressaud, A.; Laronze, H.; Guillen, F.; Gravereau, P. Structural features of new rare earth-based mixed anions (O, S, F) compounds: relationships between optical absorption and rare earth environment Solid State Sciences 4 (2002) 1471-1479
Space group: P n n m
Cell volume: 654.017
Cell parameters: 5.804; 5.784; 19.482; 90; 90; 90;

COD ID: 1533523
CIF file	Formula: - Al6 O11 Sr2 - Comments: Takeda, Takashi; Takahashi, Kasori; Uheda, Kyota; Takizawa, Hirotsugu; Endo, Tadashi Crystal Structure and Luminescence Properties of Sr~2~Al~6~O~11~:Eu^2+^ Funtai oyobi Funmatsu Yakin 49(12) (2002) 1128-1133 Space group: P n n m Cell volume: 899.528 Cell parameters: 21.9145; 4.8843; 8.4039; 90; 90; 90;

COD ID: 1534177
CIF file	Formula: - Br2 Hg K2 N2 O12 - Comments: Aurivillius, K.; Stalhandske, C. X-Ray Studies on the Mercury(II) Bromates K2 Hg (Br O3)2 (N O3)2 and Hg (Br O3)2 (H2 O)2 Acta Chemica Scandinavica, Series A: (28,1974-) 35 (1981) 537-544 Space group: P n n m Cell volume: 581.376 Cell parameters: 14.17; 7.254; 5.656; 90; 90; 90;

COD ID: 1534245
CIF file	Formula: - Br2 Yb - Comments: Beck, H.P.; Baernighausen, H. Zur Kristallchemie der Ytterbium(II)-Halogenide Yb Cl2 und Yb Br2 Zeitschrift fuer Anorganische und Allgemeine Chemie 386 (1971) 221-228 Space group: P n n m Cell volume: 200.784 Cell parameters: 6.63; 6.93; 4.37; 90; 90; 90;

COD ID: 1534857
CIF file	Formula: - H24 Ni2 O18 P2 - Comments: Haag, J.M.; LeBret, G.C.; Cleary, D.A.; Twamley, B. Room Temperature Synthesis and Solid-State Structure of Ni2 P2 O6 . 12 H2 O Journal of Solid State Chemistry 178 (2005) 1308-1311 Space group: P n n m Cell volume: 1524.13 Cell parameters: 11.2418; 18.5245; 7.3188; 90; 90; 90;

COD ID: 1535004
CIF file	Formula: - Be2 Cl6 Te7 - Comments: Beck, J.; Fischer, A.; Stankowski, A. Polymere, bandfoermige Tellurkationen in den Strukturen des Chloroberyllats Te7 (Be2 Cl6) und des Chlorobismuthats (Te4) (Te10) (Bi4 Cl16) Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 2542-2548 Space group: P n n m Cell volume: 878.735 Cell parameters: 5.416; 9.7479; 16.6444; 90; 90; 90;

COD ID: 1535533
CIF file	Formula: - Cs3 Tb7 Te12 - Comments: Tougait, O.; Noel, H.; Ibers, J.A. Serendipitous syntheses of the series Cs3 Ln7 Te12 (Ln = Sm, Gd, Tb): compounds with large tunnels Solid State Sciences 3 (2001) 513-518 Space group: P n n m Cell volume: 1684.46 Cell parameters: 13.5708; 28.116; 4.4147; 90; 90; 90;

COD ID: 1535535
CIF file	Formula: - Cs3 Gd7 Te12 - Comments: Tougait, O.; Noel, H.; Ibers, J.A. Serendipitous syntheses of the series Cs3 Ln7 Te12 (Ln = Sm, Gd, Tb): compounds with large tunnels Solid State Sciences 3 (2001) 513-518 Space group: P n n m Cell volume: 1701.26 Cell parameters: 13.6064; 28.209; 4.4324; 90; 90; 90;

COD ID: 1535537
CIF file	Formula: - Cs3 Sm7 Te12 - Comments: Tougait, O.; Ibers, J.A.; Noel, H. Serendipitous syntheses of the series Cs3 Ln7 Te12 (Ln = Sm, Gd, Tb): compounds with large tunnels Solid State Sciences 3 (2001) 513-518 Space group: P n n m Cell volume: 1680.3 Cell parameters: 13.259; 28.332; 4.473; 90; 90; 90;

COD ID: 1535807
CIF file	Formula: - Cl4 H26 O14 Sc2 - Comments: Ilyukhin, A.B.; Petrosyants, S.P. Synthesis and crystal structure of (Sc (O H) (H2 O)5)2 X4 * 2(H2 O) (X= Cl, Br) Zhurnal Neorganicheskoi Khimii 39 (1994) 1517-1520 Space group: P n n m Cell volume: 972.261 Cell parameters: 8.685; 15.646; 7.155; 90; 90; 90;

COD ID: 1535809
CIF file	Formula: - Br4 H26 O14 Sc2 - Comments: Ilyukhin, A.B.; Petrosyants, S.P. Synthesis and crystal structure of (Sc (O H) (H2 O)5)2 X4 .2(H2 O) (X=Cl,Br) Zhurnal Neorganicheskoi Khimii 39 (1994) 1517-1520 Space group: P n n m Cell volume: 1049.51 Cell parameters: 8.926; 16.089; 7.308; 90; 90; 90;

COD ID: 1536311
CIF file	Formula: - C4 Cd N6 - Comments: Juergens, B.; Schnick, W.; Irran, E.; Hoeppe, H.A. Phase transition of a dicyanamide with rutile-like structure: syntheses and crystal structures of alpha- and beta- (Cd (N (C N)2)2) Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 219-223 Space group: P n n m Cell volume: 361.323 Cell parameters: 6.2462; 7.5292; 7.683; 90; 90; 90;

COD ID: 1536380
CIF file	Formula: - Al2 Ba3 F12 - Comments: Kaiser, V.; Babel, D. Zur Kristallstruktur von Ba3 Al2 F12 Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 794-798 Space group: P n n m Cell volume: 960.357 Cell parameters: 10.203; 9.885; 9.522; 90; 90; 90;

COD ID: 1536502
CIF file	Formula: - Al4 Ba6 F24 - Comments: Domesle, R.; Hoppe, R. Das erste Cyclo-Fluoroaluminat: Ba3 Al2 F12 = Ba6 F4 (Al4 F20) (Mit einer Bemerkung ueber Ba3 Ti2 F10 O2) Zeitschrift fuer Anorganische und Allgemeine Chemie 495 (1982) 27-28 Space group: P n n m Cell volume: 955.288 Cell parameters: 10.187; 9.869; 9.502; 90; 90; 90;

COD ID: 1536512
CIF file	Formula: - Li13 Pd11.86 Si12.14 - Comments: Pavlyuk, V.V.; Kevorkov, D.G.; Bodak, O.I.; Pecharskii, V.K. Crystal structure of Li13 Pd12 Si12 Kristallografiya 40 (1995) 183-184 Space group: P n n m Cell volume: 1033.13 Cell parameters: 18.339; 12.786; 4.406; 90; 90; 90;

COD ID: 1536550
CIF file	Formula: - C6 H18 Ga N9 O3 S6 - Comments: Petrosyants, S.P.; Ilyukhin, A.B. Crystal structure of (NH4)3(Ga(NCS)6)3H2O Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 19 (1993) 839-839 Space group: P n n m Cell volume: 1167.86 Cell parameters*: 8.734; 9.858; 13.564; 90; 90; 90;

COD ID: 1536570
CIF file	Formula: - I2 Li5 S3 Sb - Comments: Pfitzner, A.; Rau, F.; Preitschaft, C. (Li I)2 Li3 Sb S3: a mixed alkali metal halide thioantimonate with a novel tetrahedron network Zeitschrift fuer Anorganische und Allgemeine Chemie 630 (2004) 75-79 Space group: P n n m Cell volume: 1061.57 Cell parameters: 10.4364; 13.5085; 7.5299; 90; 90; 90;

COD ID: 1536809
CIF file	Formula: - Ga Li3 Na2 O4 - Comments: Koehler, J.; Hoppe, R. Das erste Inselgallat mit unterschiedlichen Gegen-Kationen: Li3 Na2 (Ga O4) Zeitschrift fuer Anorganische und Allgemeine Chemie 495 (1982) 7-15 Space group: P n n m Cell volume: 427.941 Cell parameters: 8.266; 7.9461; 6.5153; 90; 90; 90;

COD ID: 1536969
CIF file	Formula: - Cu7 In6 Sr - Comments: Zaremba, V.I.; Muts, I.R.; Hoffmann, R.D.; Poettgen, R. (Cu7) cluster in Sr Cu7 In6 - synthesis and structure refinement of a twinned crystal Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 2330-2336 Space group: P n n m Cell volume: 2023.93 Cell parameters: 12.617; 12.617; 12.714; 90; 90; 90;

COD ID: 1537088
CIF file	Formula: - Cs3 H6 Ir3 K O35 S8 - Comments: Zhilyaev, A.N.; Fomina, T.A.; Larina, T.B.; Koz'min, P.A.; Surazhskaya, M.D.; Baranovskii, I.B. Trinuclear oxosulfatocomplexes of iridium Zhurnal Neorganicheskoi Khimii 36 (1991) 400-405 Space group: P n n m Cell volume: 5696.14 Cell parameters: 9.966; 21; 27.217; 90; 90; 90;

COD ID: 1537329
CIF file	Formula: - Cu Se2 - Comments: Gattow, G. Die Kristallstruktur von Cu Se2 Zeitschrift fuer Anorganische und Allgemeine Chemie 340 (1965) 312-318 Space group: P n n m Cell volume: 122.396 Cell parameters: 5.103; 6.292; 3.812; 90; 90; 90;

COD ID: 1537791
CIF file	Formula: - Pt Sb Sn - Comments: Bhan, S.; Goedecke, T.; Schubert, K. Konstitution einiger Mischungen des Platins mit B-Elementen (B = Sn, Sb, Te) Journal of the Less-Common Metals 19 (1969) 121-121 Space group: P n n m Cell volume: 137.956 Cell parameters: 6.67; 5.59; 3.7; 90; 90; 90;

COD ID: 1537919
CIF file	Formula: - C0.5 Ti0.11 V0.89 - Comments: Emiraliev, A.; Karimov, I.; Faizullaev, F.; Patiev, M. Formation of superlattice structure of the antiCaCl-2 type in the Ti-V-C system Kristallografiya 33 (1988) 778-780 Space group: P n n m Cell volume: 66.51 Cell parameters: 5.01; 4.592; 2.891; 90; 90; 90;

COD ID: 1538286
CIF file	Formula: - In K2 Na3 O4 - Comments: Hoppe, R.; Glaum, H. Ein neues Oxoindat K2 Na3 (In O4) Zeitschrift fuer Anorganische und Allgemeine Chemie 557 (1988) 31-39 Space group: P n n m Cell volume: 667.755 Cell parameters: 9.555; 9.276; 7.534; 90; 90; 90;

COD ID: 1538312
CIF file	Formula: - Cr5 H10 O28 Zr4 - Comments: Lundgren, G. On the crystal structure of a zirconium hydroxide chromate Arkiv foer Kemi 13 (1958) 59-85 Space group: P n n m Cell volume: 1091.88 Cell parameters: 11.63; 13.65; 6.878; 90; 90; 90;

COD ID: 1538912
CIF file	Formula: - Os Sb2 - Comments: Kuz'min, R.N.; Zhuravlev, N.N.; Losievskaya, S.A. The atomic structures of Ru Sb2 and Os Sb2 Kristallografiya 5 (1960) 218-223 Space group: P n n m Cell volume: 125.707 Cell parameters: 5.912; 6.653; 3.196; 90; 90; 90;

COD ID: 1539122
CIF file	Formula: - S12 - Comments: Steidel, J.; Steudel, R.; Kutoglu, A. Roentgenstrukturanalysen von Cyclododecaschwefel (S12) und Cyclododecaschwefel-1-Kohlendisulfid ((S12) * (C S2)) Zeitschrift fuer Anorganische und Allgemeine Chemie 476 (1981) 171-178 Space group: P n n m Cell volume: 625.114 Cell parameters: 4.725; 9.104; 14.532; 90; 90; 90;

COD ID: 1539277
CIF file	Formula: - Ge2 Pt - Comments: Schubert, K.; Bhan, S.; Balk, M.; Breimer, H.; Stolz, E.; Esslinger, P. Einige strukturelle Ergebnisse an metallischen Phasen. IV Naturwissenschaften 46 (1959) 647-648 Space group: P n n m Cell volume: 104.358 Cell parameters: 6.197; 5.779; 2.914; 90; 90; 90;

COD ID: 1539857
CIF file	Formula: - Br29 K N6 Th12 - Comments: Braun, T.P.; Simon, A.; Boettcher, F.; Ueno, F. A Th12 N6 X29 (A= Li-Rb; X= Cl, Br): ein neuartiger Typ von Thorium-Clustern mit Th12 N6 - Kern Angewandte Chemie (German Edition) 107 (1995) 647-648 Space group: P n n m Cell volume: 2936.54 Cell parameters: 17.524; 11.943; 14.031; 90; 90; 90;

COD ID: 1539929
CIF file	Formula: - Se Zr2 - Comments: Weirich, T.E. The crystal structure of Zr2 Se reinvestigated by electron crystallography and X-ray powder diffraction Kristallografiya 49 (2004) 445-455 Space group: P n n m Cell volume: 716.591 Cell parameters: 12.5985; 15.7448; 3.61256; 90; 90; 90;

COD ID: 1540121
CIF file	Formula: - Cu2 I6 Tl4 - Comments: Hoyer, M.; Hartl, H. Die Kristallstruktur von TL4 CU2 I6 Zeitschrift fuer Anorganische und Allgemeine Chemie 587 (1990) 23-28 Space group: P n n m Cell volume: 820.076 Cell parameters: 9.196; 9.552; 9.336; 90; 90; 90;

COD ID: 1540167
CIF file	Formula: - H3 I Na2 O6 - Comments: Jansen, M.; Rehr, A. Na2H3IO6, eine Variante der Markasitstruktur Zeitschrift fuer Anorganische und Allgemeine Chemie 567 (1988) 95-100 Space group: P n n m Cell volume: 250.188 Cell parameters: 4.697; 5.299; 10.052; 90; 90; 90;

COD ID: 1540268
CIF file	Formula: - Sb2 Zr - Comments: Kjekshus, A. On the crystal structure of ZrSb2 and alpha-HfSb2 Acta Chemica Scandinavica (1-27,1973-42,1988) 26 (1972) 1633-1639 Space group: P n n m Cell volume: 579.063 Cell parameters: 14.9684; 9.9672; 3.8813; 90; 90; 90;

COD ID: 1540270
CIF file	Formula: - Hf Sb2 - Comments: Kjekshus, A. On the crystal structure of ZrSb2 and alpha-HfSb2 Acta Chemica Scandinavica (1-27,1973-42,1988) 26 (1972) 1633-1639 Space group: P n n m Cell volume: 575.902 Cell parameters: 14.989; 9.9781; 3.8506; 90; 90; 90;

COD ID: 1540753
CIF file	Formula: - Ag H6 N3 O3 - Comments: Zachwieja, U.; Jacobs, H. Kolumnarstrukturen bei Tri- und Diamminnitraten, (M (N H3)3) (N O3) und (M (N H3)2) (N O3) des einwertigen Kupfres und Silbers Zeitschrift fuer Anorganische und Allgemeine Chemie 571 (1989) 37-50 Space group: P n n m Cell volume: 539.006 Cell parameters: 10.573; 8.11; 6.286; 90; 90; 90;

COD ID: 1540925
CIF file	Formula: - In S - Comments: Schubert, K.; Gunzel, E.; Dorre, E. Kristallchemische Ergebnisse an Phasen aus B-Elementen Naturwissenschaften 41 (1954) 448-448 Space group: P n n m Cell volume: 186.293 Cell parameters: 4.443; 10.642; 3.94; 90; 90; 90;

COD ID: 1541357
CIF file	Formula: - Ni4 P2 Sm - Comments: Orishchin, S.V.; Glovyak, T.; Chikhrii, S.I.; Kuz'ma, Yu.B. New samarium nickel phosphide Sm Ni4 P2 and its crystal structure Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya B: Geologichni, Khimichni ta Biologichni Nauki 1988 (1988) 54-57 Space group: P n n m Cell volume: 450.551 Cell parameters: 11.185; 10.759; 3.744; 90; 90; 90;

COD ID: 1541359
CIF file	Formula: - Ni4 P2 Sm - Comments: Orishchin, S.V.; Chikhrii, S.I.; Glovyak, T.; Kuz'ma, Yu.B. New samarium nickel phosphide Sm Ni4 P2 and its crystal structure Doklady Akademii Nauk Ukrainskoi SSR, Serie B: Geol.Khim.Biol., Nauki 1988 (1988) 56-59 Space group: P n n m Cell volume: 571.396 Cell parameters: 14.185; 10.759; 3.744; 90; 90; 90;

COD ID: 1541786
CIF file	Formula: - Li2 N5 O15 Pr - Comments: Manek, E.; Meyer, G. Synthesis and Structure of the first Anhydrous ternary Lithium Nitrates of the Lanthanides, Li2 (M (NO3)5) (M=La, Pr-Eu) Zeitschrift fuer Anorganische und Allgemeine Chemie 619 (1993) 513-516 Space group: P n n m Cell volume: 1118.99 Cell parameters: 9.02; 10.532; 11.779; 90; 90; 90;

COD ID: 1541843
CIF file	Formula: - Cr4.28 H10.88 Hf4 O26.28 - Comments: Hansson, M.; Mark, W. The crystal structure of a basic hafnium chromate Acta Chemica Scandinavica (1-27,1973-42,1988) 27 (1973) 3467-3476 Space group: P n n m Cell volume: 1073.85 Cell parameters: 11.543; 13.587; 6.847; 90; 90; 90;

COD ID: 1541857
CIF file	Formula: - Cl4 H26 O14 Sc2 - Comments: Levason, W.; Reid, G.; Webster, M. Crystal structure of di(mue-hydroxo) bis(pentaaquascandium(III)) tetrachloride dihydrate at 120 K Private Communication 2002 (2002) 1-1 Space group: P n n m Cell volume: 966.802 Cell parameters: 15.678; 8.6611; 7.1199; 90; 90; 90;

COD ID: 1541861
CIF file	Formula: - Cr4.95 H7.3 O26.5 Zr4 - Comments: Mark, W. The Crystal structure of Zr4 (O H)6 (Cr O4)5 H2 O Acta Chemica Scandinavica (1-27,1973-42,1988) 27 (1973) 177-190 Space group: P n n m Cell volume: 1092.66 Cell parameters: 11.629; 13.6534; 6.8818; 90; 90; 90;

COD ID: 1543664
CIF file	Formula: - C Fe2 - Comments: Oila, Adrian; Lung, Chi; Bull, Steve Elastic properties of eta carbide (η-Fe2C) from ab initio calculations: application to cryogenically treated gear steel Journal of Materials Science 49(5) (2013) 2383 Space group: P n n m Cell volume: 57.175 Cell parameters: 4.722; 4.271; 2.835; 90; 90; 90;

COD ID: 1544548
CIF file	Formula: - Al0.84 H Mg0.07 O2 Si0.07 - Comments: Komatsu, K.; Sano-Furukawa, A.; Kagi, H. Effects of Mg and Si ions on the symmetry of delta-AlOOH Physics and Chemistry of Minerals 38 (2011) 727-733 Space group: P n n m Cell volume: 56.2174 Cell parameters: 4.70456; 4.21232; 2.83681; 90; 90; 90;

COD ID: 1544636

Formula: - As H O5 Zn2 -
Comments: Jinnouchi, S.; Yoshiasa, A.; Sugiyama, K.; Shimura, R.; Arima, H.; Momma, K.; Miyawaki, R. Crystal structure refinements of legrandite, adamite, and paradamite: The complex structure and characteristic hydrogen bonding network of legrandite Journal of Mineralogical and Petrological Sciences 111 (2016) 35-43
Space group: P n n m
Cell volume: 434.28
Cell parameters: 8.3428; 8.566; 6.0769; 90; 90; 90;

COD ID: 1544680
CIF file	Formula: - As H O5 Zn2 - Comments: Kato, T.; Miura, Y. The crystal structures of adamite and paradamite Mineralogical Journal 8 (1977) 320-328 Space group: P n n m Cell volume: 432.9 Cell parameters: 8.386; 8.552; 6.036; 90; 90; 90;

COD ID: 1546445
CIF file	Formula: - C11 H10 B I N4 - Comments: Böser, Richard; Haufe, Lisa Cathrin; Freytag, Matthias; Jones, P. G.; Hörner, Gerald; René, Frank Completing the series of boron-nucleophilic cyanoborates: Boryl anions of type (NHC)−B(CN)2− Chem. Sci. (2017) Space group: P n n m Cell volume: 1242.01 Cell parameters: 8.8243; 10.9964; 12.7995; 90; 90; 90;

COD ID: 1547219

Formula: - C8 H26 I8 N4 O2 Pb3 -
Comments: Petrov, Andrey A.; Sokolova, Iuliia P.; Belich, Nikolai A.; Peters, Georgy S.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Khrustalev, Victor N.; Petrov, Andrey V.; Grätzel, Michael; Goodilin, Eugene A.; Tarasov, Alexey B. Crystal Structure of DMF-Intermediate Phases Uncovers the Link Between CH3NH3PbI3 Morphology and Precursor Stoichiometry The Journal of Physical Chemistry C 121(38) (2017) 20739
Space group: P n n m
Cell volume: 1716.5
Cell parameters: 17.165; 21.955; 4.5549; 90; 90; 90;

COD ID: 1548499
CIF file	Formula: - C118 H90 Au4 Br F12 N4 O13 P4 S4 - Comments: Lin Rong Er Gold rectangle, silver rings and helices - A study of self-assembly and molecular recognition of metallo-supramolecules Ph.D Thesis - NATIONAL UNIVERSITY OF SINGAPORE (2005) 1 Space group: P n n m Cell volume: 14047.2 Cell parameters: 27.4266; 21.6592; 23.647; 90; 90; 90;

COD ID: 1548813
CIF file	Formula: - C2 H2 Co N4 - Comments: Zhao, Qing; Kulik, Heather J. Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U. Journal of chemical theory and computation (2018) Space group: P n n m Cell volume: 188.707 Cell parameters: 6.5694; 8.8057; 3.2621; 90; 90; 90;

COD ID: 1548814
CIF file	Formula: - C2 H2 N4 Ni - Comments: Zhao, Qing; Kulik, Heather J. Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U. Journal of chemical theory and computation (2018) Space group: P n n m Cell volume: 182.87 Cell parameters: 6.457; 8.768; 3.23; 90; 90; 90;

COD ID: 1548815
CIF file	Formula: - C2 H2 Fe N4 - Comments: Zhao, Qing; Kulik, Heather J. Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U. Journal of chemical theory and computation (2018) Space group: P n n m Cell volume: 195.18 Cell parameters: 6.6655; 8.7923; 3.3304; 90; 90; 90;

COD ID: 1549161

Formula: - C20 H24 N2 O10 Zn2 -
Comments: Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive N,N'-containing linkers IUCrJ 5(3) (2018)
Space group: P n n m
Cell volume: 1052.3
Cell parameters: 7.4159; 19.318; 7.3457; 90; 90; 90;

COD ID: 1552053

Formula: - C72.5 H40 N12.8 O22.91 Pd2 -
Comments: Aleksandr V. Zhukhovitskiy; Mingjiang Zhong; Eric G. Keeler; Vladimir K. Michaelis; Jessie E. P. Sun; Michael J. A. Hore; Darrin J. Pochan; Robert G. Griffin; Adam P. Willard; Jeremiah A. Johnson Highly branched and loop-rich gels via formation of metal-organic cages linked by polymers Nature Chemistry 8 (2016) 33-41
Space group: P n n m
Cell volume: 8265.2
Cell parameters: 28.134; 15.138; 19.4067; 90; 90; 90;

COD ID: 1554195
CIF file	Formula: - C28 H16 Mg3 N0 O16 P2 - Comments: Li, Lan; Yin, Qi; Li, Hong-Fang; Liu, Tian-Fu; Cao, Rong Rational design of phosphonocarboxylate metal‒organic frameworks for light hydrocarbon separations Materials Chemistry Frontiers 2(8) (2018) 1436 Space group: P n n m Cell volume: 2414.7 Cell parameters: 11.302; 13.5426; 15.7763; 90; 90; 90;

COD ID: 1557702

Formula: - C36 H56 Cl21 I N4 Te4 -
Comments: Hauge, Sverre; Maroy, Kjartan Syntheses and Crystal Structures of Phenyltrimethylammonium Salts of Hexachlorotellurate(IV), [C6H5(CH3)3N]2[TeCl6], catena-poly[(Di-mu-chlorobis{tetrachlorotellurate(IV)})-mu-bromine], [C6H5(CH3)3N]2n[Te2Cl10.Br2]n and Di-mu-chlorobis{tetrachlorotellurate(IV)} catena-poly[(mu-chlorobis{pentachlorotellurate(IV)})-mu-iodine(I)], [C6H5(CH3)3N]4n[Te2Cl10]n[Te2Cl11.I]n Acta Chemica Scandinavica 50 (1996) 1095-1101
Space group: P n n m
Cell volume: 3332.3
Cell parameters: 11.952; 16.475; 16.923; 90; 90; 90;

COD ID: 1559471

Formula: - Bi6 Br7 -
Comments: Stroganova, Ekaterina A.; Troyanov, Sergey I.; Morozov, Igor V.; Kuznetsov, Alexey N. Bismuth Polycations Revisited: Alternative Synthesis and Electronic Structure of Bi6Br7, and Bonding in Main-Group Polyatomic Ions from a Direct Space Perspective Crystals 10(10) (2020) 940
Space group: P n n m
Cell volume: 3306.65
Cell parameters: 15.4996; 23.6435; 9.0231; 90; 90; 90;

COD ID: 1561010
CIF file	Formula: - Ba2 Cl2 O6 Se2 Zn - Comments: Li, Qiang; Geng, Lei; Lu, Hong-Yan; Dai, Kai; Cheng, Wen-Dan Crystal structures and characterizations of two new selenite chlorides: 1D Ba2Zn(SeO3)2Cl2 and 2D BaZn2(SeO3)2Cl2 Journal of Solid State Chemistry 265 (2018) 117-122 Space group: P n n m Cell volume: 460.93 Cell parameters: 6.7677; 12.6321; 5.3916; 90; 90; 90;

COD ID: 1561674

Formula: - As4 Eu3 In2 -
Comments: Childs, Amanda B.; Baranets, Sviatoslav; Bobev, Svilen Five new ternary indium-arsenides discovered. Synthesis and structural characterization of the Zintl phases Sr3In2As4, Ba3In2As4, Eu3In2As4, Sr5In2As6 and Eu5In2As6 Journal of Solid State Chemistry 278 (2019) 120889
Space group: P n n m
Cell volume: 497.46
Cell parameters: 6.8262; 16.513; 4.4132; 90; 90; 90;

COD ID: 1561676

Formula: - As4 In2 Sr3 -
Comments: Childs, Amanda B.; Baranets, Sviatoslav; Bobev, Svilen Five new ternary indium-arsenides discovered. Synthesis and structural characterization of the Zintl phases Sr3In2As4, Ba3In2As4, Eu3In2As4, Sr5In2As6 and Eu5In2As6 Journal of Solid State Chemistry 278 (2019) 120889
Space group: P n n m
Cell volume: 512.25
Cell parameters: 6.9362; 16.6757; 4.4287; 90; 90; 90;

COD ID: 1561686
CIF file HKL data	Formula: - Ba3 Cl K S9 Sb4 - Comments: Zhao, Hua-Jun; Liu, Peng-Fei Synthesis, crystal and electronic structure, and optical property of the pentanary chalcohalide Ba3KSb4S9Cl Journal of Solid State Chemistry 232 (2015) 37-41 Space group: P n n m Cell volume: 1968 Cell parameters: 26.92; 8.139; 8.981; 90; 90; 90;

COD ID: 1561739

Formula: - Ba8 Pd Se16 U2 -
Comments: Prakash, Jai; Mesbah, Adel; Lebègue, Sébastien; Malliakas, Christos D.; Ibers, James A. Synthesis, crystal structure, resistivity, and electronic structure of the U(V) quaternary polyselenide Ba8PdU2Se12(Se2)2 Journal of Solid State Chemistry 230 (2015) 70-74
Space group: P n n m
Cell volume: 1600.7
Cell parameters: 9.49; 12.24; 13.78; 90; 90; 90;

COD ID: 1561959

Formula: - C5 H N O16.83 U3 -
Comments: Zhang, Yingjie; Bhadbhade, Mohan; Karatchevtseva, Inna; Price, Jason R.; Liu, Hao; Zhang, Zhaoming; Kong, Linggen; Čejka, Jiří; Lu, Kim; Lumpkin, Gregory R. Uranium(VI) coordination polymers with pyromellitate ligand: Unique 1D channel structures and diverse fluorescence Journal of Solid State Chemistry 226 (2015) 42-49
Space group: P n n m
Cell volume: 4187.6
Cell parameters: 12.647; 13.284; 24.926; 90; 90; 90;

COD ID: 1562141
CIF file	Formula: - B6 H3 K3 N Na O15 - Comments: Ortner, Teresa S.; Wurst, Klaus; Perfler, Lukas; Tribus, Martina; Huppertz, Hubert Hydrothermal synthesis and characterization of the first mixed alkali borate-nitrate K3Na[B6O9(OH)3]NO3 Journal of Solid State Chemistry 221 (2015) 66-72 Space group: P n n m Cell volume: 1482.5 Cell parameters: 13.208; 9.1067; 12.325; 90; 90; 90;

COD ID: 1563010

Formula: - As0.9 Co2 H O5 P0.1 -
Comments: de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry 188 (2012) 1-10
Space group: P n n m
Cell volume: 425.99
Cell parameters: 8.2447; 8.5667; 6.0313; 90; 90; 90;

COD ID: 1563011

Formula: - As0.75 Co2 H O5 P0.25 -
Comments: de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry 188 (2012) 1-10
Space group: P n n m
Cell volume: 421.35
Cell parameters: 8.2119; 8.5341; 6.0123; 90; 90; 90;

COD ID: 1563012

Formula: - As0.25 Co2 H O5 P0.75 -
Comments: de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry 188 (2012) 1-10
Space group: P n n m
Cell volume: 407.4
Cell parameters: 8.0979; 8.4325; 5.9661; 90; 90; 90;

COD ID: 1563013

Formula: - As0.1 Co2 H O5 P0.9 -
Comments: de Pedro, I.; Rojo, J.M.; Rodríguez Fernández, J.; Sanchez Marcos, J.; Fernández-Díaz, M.T.; Rojo, T. Heat capacity and neutron diffraction studies on the frustrated magnetic Co2(OH)(PO4)1−x(AsO4)x [0≤x≤1] solid solution Journal of Solid State Chemistry 188 (2012) 1-10
Space group: P n n m
Cell volume: 402.35
Cell parameters: 8.0509; 8.3946; 5.9533; 90; 90; 90;

COD ID: 1563028
CIF file	Formula: - Sb2 Se11.68 Tm4 - Comments: Babo, Jean-Marie; Albrecht-Schmitt, Thomas E. Two new ternary lanthanide antimony chalcogenides: Yb4Sb2S11.25 and Tm4Sb2Se11.68 containing chalcogenide Q2− and dichalcogenide (Q2)2− anions Journal of Solid State Chemistry 187 (2012) 264-268 Space group: P n n m Cell volume: 922.6 Cell parameters: 13.126; 5.6233; 12.499; 90; 90; 90;

COD ID: 1563029
CIF file	Formula: - S2.81 Sb0.5 Yb - Comments: Babo, Jean-Marie; Albrecht-Schmitt, Thomas E. Two new ternary lanthanide antimony chalcogenides: Yb4Sb2S11.25 and Tm4Sb2Se11.68 containing chalcogenide Q2− and dichalcogenide (Q2)2− anions Journal of Solid State Chemistry 187 (2012) 264-268 Space group: P n n m Cell volume: 801.54 Cell parameters: 12.4455; 5.3412; 12.0579; 90; 90; 90;

COD ID: 1563124
CIF file	Formula: - Cu2 H O5 P - Comments: Belik, Alexei A.; Naumov, Panče; Kim, Jungeun; Tsuda, Shunsuke Low-temperature structural phase transition in synthetic libethenite Cu2PO4OH Journal of Solid State Chemistry 184(11) (2011) 3128-3133 Space group: P n n m Cell volume: 396.8 Cell parameters: 8.0553; 8.375; 5.8818; 90; 90; 90;

COD ID: 1563193
CIF file	Formula: - As Co2 H O5 - Comments: de Pedro, I.; Rojo, J.M.; Pizarro, J.L.; Rodríguez Fernández, J.; Arriortua, M.I.; Rojo, T. Magnetostructural correlations in the antiferromagnetic Co2−x Cux(OH)AsO4 (x=0 and 0.3) phases Journal of Solid State Chemistry 184(8) (2011) 2075-2082 Space group: P n n m Cell volume: 427.8 Cell parameters: 8.277; 8.559; 6.0387; 90; 90; 90;

COD ID: 1563194

Formula: - As Co1.7 Cu0.3 H O5 -
Comments: de Pedro, I.; Rojo, J.M.; Pizarro, J.L.; Rodríguez Fernández, J.; Arriortua, M.I.; Rojo, T. Magnetostructural correlations in the antiferromagnetic Co2−x Cux(OH)AsO4 (x=0 and 0.3) phases Journal of Solid State Chemistry 184(8) (2011) 2075-2082
Space group: P n n m
Cell volume: 428.58
Cell parameters: 8.3156; 8.5234; 6.0468; 90; 90; 90;

COD ID: 1563253
CIF file	Formula: - C24 H41 Mo12 N4 O62 P Zn - Comments: Wei, Mei-Lin; Zhuang, Peng-Fei; Miao, Qiu-Xiang; Wang, Yan Two highly proton-conductive molecular hybrids based on ionized water clusters and poly-Keggin-anion chains Journal of Solid State Chemistry 184(6) (2011) 1472-1477 Space group: P n n m Cell volume: 3227.6 Cell parameters: 10.3055; 15.8867; 19.714; 90; 90; 90;

COD ID: 1563254
CIF file	Formula: - C24 H42 Mn Mo12 N4 O62.5 P - Comments: Wei, Mei-Lin; Zhuang, Peng-Fei; Miao, Qiu-Xiang; Wang, Yan Two highly proton-conductive molecular hybrids based on ionized water clusters and poly-Keggin-anion chains Journal of Solid State Chemistry 184(6) (2011) 1472-1477 Space group: P n n m Cell volume: 3283.3 Cell parameters: 10.2653; 16.037; 19.944; 90; 90; 90;

COD ID: 1563957
CIF file	Formula: - C16 H8 O16 Zr3 - Comments: Lee, Seungkyu; Yaghi, Omar M. 'Eye' of the molecule-a viewpoint. Faraday discussions 231 (2021) 145-149 Space group: P n n m Cell volume: 4266.2 Cell parameters: 13.4687; 14.8959; 21.264; 90; 90; 90;

COD ID: 1564619

Formula: - C39 H57 Cd2 N9 O13 -
Comments: Lu, Lu; Wang, Jun; Zhou, Shanhe; Zhong, Yuyu; Sun, Yanchun; Wu, Xiren; Singh, Amita; Kumar, Abhinav Two new coordination polymers driven by polycarboxylate and N-donor spacers: Photocatalytic performance and theoretical analysis Inorganica Chimica Acta 508 (2020) 119647
Space group: P n n m
Cell volume: 2310.1
Cell parameters: 7.1024; 14.4921; 22.4437; 90; 90; 90;

COD ID: 1564889
CIF file	Formula: - Fe S2 - Comments: Ma, KeYuan; Lefèvre, Robin; Li, Qingtian; Lago, Jorge; Blacque, Olivier; Yang, Wanli; von Rohr, Fabian O. Synthetic control over polymorph formation in the d-band semiconductor system FeS2 Chemical Science (2021) Space group: P n n m Cell volume: 81.731 Cell parameters: 4.4474; 5.4287; 3.3852; 90; 90; 90;

COD ID: 1565367

Formula: - C16 N8 Nb6.4 O144.78 P4 W29.6 -
Comments: Shmakova, Alexandra A.; Sukhikh, Taisiya S.; Volchek, Victoria V.; Yanshole, Vadim; Stass, Dmitri V.; Filatov, Eugeniy Yu.; Glebov, Eugeniy M.; Abramov, Pavel A.; Sokolov, Maxim N. Niobium uptake by {P2W12} polyoxoanion with [NbO(C2O4)2(H2O)2]− as Nb source Inorganica Chimica Acta 502 (2020) 119319
Space group: P n n m
Cell volume: 7856.1
Cell parameters: 19.5879; 21.9143; 18.3017; 90; 90; 90;

COD ID: 1566037
CIF file	Formula: - Ca7 Mg O16 Si4 - Comments: Bao, Xinjian; He, Mingyue; Zhang, Zhigang; Liu, Xi Crystal Structure and Some Thermodynamic Properties of Ca7MgSi4O16-Bredigite Crystals 11(1) (2020) 14 Space group: P n n m Cell volume: 1344 Cell parameters: 18.3434; 6.7313; 10.8844; 90; 90; 90;

COD ID: 1566255

Formula: - C6 H0 Ca3 K1.952 Na0 O29.167 U2 -
Comments: Jakub Plasil; Jiri Cejka; Jiri Sejkora; Jan Hlousek; Radek Skoda; Milan Novak; Michal Dusek; Ivana Cisarova; Ivan Nemec; Jana Ederova Linekite, K2Ca3[(UO2)(CO3)3]2 . 8H2O, a new uranyl carbonate mineral from Jachymov, Czech Republic Journal of GeoSciences 62 (2017) 201-213
Space group: P n n m
Cell volume: 5622
Cell parameters: 17.0069; 18.0273; 18.3374; 90; 90; 90;

COD ID: 1569046

Formula: - C2 Cu O4 -
Comments: Kornyakov, Ilya V.; Gurzhiy, Vladislav V.; Kuz'mina, Mariya A.; Krzhizhanovskaya, Maria G.; Chukanov, Nikita V.; Chislov, Mikhail V.; Korneev, Anatolii V.; Izatulina, Alina R. Crystal Chemistry of the Copper Oxalate Biomineral Moolooite: The First Single-Crystal X-ray Diffraction Studies and Thermal Behavior. International journal of molecular sciences 24(7) (2023) 6786
Space group: P n n m
Cell volume: 77.5
Cell parameters: 5.601; 5.415; 2.5553; 90; 90; 90;

COD ID: 1569047

Formula: - C2 Cu O4 -
Comments: Kornyakov, Ilya V.; Gurzhiy, Vladislav V.; Kuz'mina, Mariya A.; Krzhizhanovskaya, Maria G.; Chukanov, Nikita V.; Chislov, Mikhail V.; Korneev, Anatolii V.; Izatulina, Alina R. Crystal Chemistry of the Copper Oxalate Biomineral Moolooite: The First Single-Crystal X-ray Diffraction Studies and Thermal Behavior. International journal of molecular sciences 24(7) (2023) 6786
Space group: P n n m
Cell volume: 77.85
Cell parameters: 5.607; 5.428; 2.5579; 90; 90; 90;

COD ID: 2000152

Formula: - C20 H16 Cu F6 N2 O4 -
Comments: Yu, K.-B.; Gou, S.-H.; You, X.-Z.; Xu, Z. Structure of catena-poly{bis(1,1,1-trifluoro-2,4-pentanedionato-κ^2^O,O')copper-μ-[(4,4'-bipyridine)-κN:κN']} Acta Crystallographica Section C 47(12) (1991) 2653-2654
Space group: P n n m
Cell volume: 1111.5
Cell parameters: 8.379; 8.379; 15.832; 90; 90; 90;

COD ID: 2002304
CIF file	Formula: - Al6 O11 Pb0.67 Sr1.33 - Comments: Ploetz, K B; Mueller-Buschbaum, Hk Darstellung und Strukturaufklaerung von Sr1.33 Pb0.67 Al6 O11 Zeitschrift fuer Anorganische und Allgemeine Chemie 491 (1982) 253-258 Space group: P n n m Cell volume: 908.2 Cell parameters: 22.129; 4.876; 8.417; 90; 90; 90;

COD ID: 2002950

Formula: - Nb5 O17 Sr5 -
Comments: Abrahams, Sidney C.; Schmalle, Helmut W.; Williams, Tim; Reller, Armin; Lichtenberg, Frank; Widmer, Daniel; Bednorz, J. Georg; Spreiter, Rolf; Bosshard, Christian; Günter, Peter Centrosymmetric or Noncentrosymmetric? Case Study and Structural Redetermination of Sr~5~Nb~5~O~17~ Acta Crystallographica, Section B 54 (1998) 399-416
Space group: P n n m
Cell volume: 735.7
Cell parameters: 32.456; 5.674; 3.995; 90; 90; 90;

COD ID: 2002951

COD ID: 2005339
CIF file Original IUCr paper	Formula: - Cl Cs3 O14 Te2 V4 - Comments: Marrot, J.; Savariault, J.-M. Tricaesium Ditellurium Tetravanadium Chloride Tetradecaoxide Acta Crystallographica Section C 52(9) (1996) 2129-2132 Space group: P n n m Cell volume: 884.7 Cell parameters: 23.608; 6.825; 5.4908; 90; 90; 90;

COD ID: 2007184
CIF file Original IUCr paper	Formula: - C6 H8 Cl8 N4 Pt - Comments: Giovanni Valle; Renato Ettorre Bis(2-chloro-1<i>H</i>-imidazol-3-ium) Hexachloroplatinate(IV), (C~3~H~4~ClN~2~)~2~[PtCl~6~] Acta Crystallographica Section C 54(4) (1998) 448-449 Space group: P n n m Cell volume: 821.75 Cell parameters: 7.596; 15.53; 6.966; 90; 90; 90;

COD ID: 2007881
CIF file Original IUCr paper	Formula: - C4 H16 Cl6 N2 Te - Comments: Ishida, Hiroyuki; Kashino, Setsuo Bis(dimethylammonium) Hexachlorotellurate(IV) Acta Crystallographica Section C 54(12) (1998) 1811-1813 Space group: P n n m Cell volume: 785.8 Cell parameters: 7.41; 14.392; 7.368; 90; 90; 90;

COD ID: 2009287

Formula: - C16 H36 Cu4 N28 Ni4 -
Comments: Janiak, Christoph; Wu, He-Ping; Klüfers, Peter; Mayer, Peter A molecular tetraamminecopper(II)-trans-diamminecopper(II) tetracyanonickelate(II) coordination compound Acta Crystallographica Section C 55(12) (1999) 1966-1969
Space group: P n n m
Cell volume: 1933.2
Cell parameters: 16.8265; 15.7626; 7.2886; 90; 90; 90;

COD ID: 2009684
CIF file Original IUCr paper	Formula: - C34 H40 Cl2 N2 P2 Pd - Comments: Burrow, R.A.; Farrar, D.H.; Honeyman, C.H. [Pd{P(C~5~H~10~N)Ph~2~}~2~Cl~2~] Acta Crystallographica Section C 50(5) (1994) 681-683 Space group: P n n m Cell volume: 1656 Cell parameters: 8.21; 12.334; 16.354; 90; 90; 90;

COD ID: 2010084
CIF file Original IUCr paper	Formula: - Cl7 H12 N3 O Sb2 - Comments: Rogers, Robin D.; Jezl, Mary L. Ammonium heptachlorooxodiantimonate(III), (NH~4~)~3~[Sb~2~Cl~7~O] Acta Crystallographica Section C 50(10) (1994) 1527-1529 Space group: P n n m Cell volume: 1492.1 Cell parameters: 11.342; 13.165; 9.993; 90; 90; 90;

COD ID: 2013237

Formula: - C12 H20 Cl4 Cu2 N16 -
Comments: Ivashkevich, Dmitry O.; Lyakhov, Alexander S.; Pytleva, Dariya S.; Voitekhovich, Sergei V.; Gaponik, Pavel N. catena-Poly[[bis[μ-1,2-bis(1-methyltetrazol-5-yl)ethane-κ^2^N^4^:N^4'^]bis[chlorocopper(II)]]-di-μ-chloro] Acta Crystallographica Section C 59(6) (2003) m221-m223
Space group: P n n m
Cell volume: 1133.4
Cell parameters: 6.732; 11.5; 14.64; 90; 90; 90;

COD ID: 2013377

Formula: - La2 Nb3 O8 S2 -
Comments: Cario, Laurent; Kabbour, Houria; Guillot-Deudon, Catherine; Meerschaut, Alain A mixed-valent niobium oxysulfide, La~2~Nb~3~S~2~O~8~ Acta Crystallographica Section C 59(6) (2003) i55-i56
Space group: P n n m
Cell volume: 892.67
Cell parameters: 9.8698; 11.7941; 7.6686; 90; 90; 90;

COD ID: 2013712

Formula: - C6 H24 Cu N4 O8 S2 -
Comments: Kim, Yang; Skelton, Brian W.; White, Allan H. catena-Poly[[trans-bis(ethane-1,2-diamine-κ^2^N,N')copper(II)]-μ-dithionato-κ^2^O:O'] and trans-diaquabis(propane-1,3-diamine-κ^2^N,N')copper(II) dithionate Acta Crystallographica Section C 59(12) (2003) m546-m548
Space group: P n n m
Cell volume: 794.78
Cell parameters: 15.5; 7.098; 7.224; 90; 90; 90;

COD ID: 2014945
CIF file Original IUCr paper	Formula: - H32 Li6 O44 V10 - Comments: Ai-Li Xie; Chun-An Ma Hexalithium hexadecahydrate decavanadate, [Li~6~(H~2~O)~16~V~10~O~28~]~<i>n~</i> Acta Crystallographica Section C 61(6) (2005) i67-i68 Space group: P n n m Cell volume: 1678.72 Cell parameters: 17.6164; 10.3189; 9.2348; 90; 90; 90;

COD ID: 2015670

Formula: - C6 H14 I4 N2 O2 Pb -
Comments: Lemmerer, Andreas; Billing, David G. Two packing motifs based upon chains of edge-sharing PbI~6~ octahedra Acta Crystallographica Section C 62(12) (2006) m597-m601
Space group: P n n m
Cell volume: 860.4
Cell parameters: 12.952; 14.489; 4.5851; 90; 90; 90;

COD ID: 2020263
CIF file	Formula: - Cl H24 N4 O20 P8 Pt2 - Comments: Jin, S.; Ito, T.; Toriumi, K.; Yamashita, M. Structure of a linear-chain chloro-bridged binuclear platinum complex, (N H4)4 (Pt2 Cl (P2 O5 H2)4) Acta Crystallographica C (39,1983-) 45 (1989) 1415-1417 Space group: P n n m Cell volume: 1187.1 Cell parameters: 9.66; 14.959; 8.215; 90; 90; 90;

COD ID: 2022274

Formula: - C48 H42 Mo6 N4 O32 -
Comments: Chen, Wen-Tong Crystal structure and photophysical properties of a novel polyoxomolybdate porphyrin Acta Crystallographica Section C 76(12) (2020)
Space group: P n n m
Cell volume: 5701.4
Cell parameters: 19.3159; 15.0183; 19.6537; 90; 90; 90;

COD ID: 2022340

Formula: - Co32.32 Ge13.68 Mn28 -
Comments: Shtender, Vitalii; Larsen, Simon R.; Sahlberg, Martin Variants of the X-phase in the Mn‒Co‒Ge system Acta Crystallographica Section C 77(4) (2021) 176-180
Space group: P n n m
Cell volume: 957.06
Cell parameters: 12.6208; 15.6878; 4.8338; 90; 90; 90;

COD ID: 2022341

Formula: - Co30.97 Ge13.25 Mn29.79 -
Comments: Shtender, Vitalii; Larsen, Simon R.; Sahlberg, Martin Variants of the X-phase in the Mn‒Co‒Ge system Acta Crystallographica Section C 77(4) (2021) 176-180
Space group: P n n m
Cell volume: 958.5
Cell parameters: 12.6427; 15.6725; 4.8374; 90; 90; 90;

COD ID: 2100343

Formula: - C6 H26 O8 -
Comments: Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt The unusual phases of anhydrous and hydrated pinacol Acta Crystallographica Section B 61(6) (2005) 689-699
Space group: P n n m
Cell volume: 628.4
Cell parameters: 6.308; 6.321; 15.759; 90; 90; 90;

COD ID: 2101671

Formula: - Al2 O5 Si -
Comments: Pilati, T.; Demartin, F.; Gramaccioli, C. M. Transferability of Empirical Force Fields in Silicates: Lattice-Dynamical Evaluation of Atomic Displacement Parameters and Thermodynamic Properties for the Al~2~OSiO~4~ Polymorphs Acta Crystallographica Section B 53(1) (1997) 82-94
Space group: P n n m
Cell volume: 342.73
Cell parameters: 7.7992; 7.905; 5.5591; 90; 90; 90;

COD ID: 2101931
CIF file Original IUCr paper	Formula: - O2 Ru - Comments: Haines, J.; Léger, J. M.; Schulte, O.; Hull, S. Neutron Diffraction Study of the Ambient-Pressure, Rutile-Type and the High-Pressure, CaCl~2~-Type Phases of Ruthenium Dioxide Acta Crystallographica Section B 53(6) (1997) 880-884 Space group: P n n m Cell volume: 61.547 Cell parameters: 4.4865; 4.4347; 3.0934; 90; 90; 90;

COD ID: 2102117

Formula: - H2 O8 P2 Zr -
Comments: Krogh Andersen, Anne Marie; Norby, Poul Ab initio structure determination and Rietveld refinement of a high-temperature phase of zirconium hydrogen phosphate and a new polymorph of zirconium pyrophosphate from in situ temperature-resolved powder diffraction data Acta Crystallographica Section B 56(4) (2000) 618-625
Space group: P n n m
Cell volume: 341.59
Cell parameters: 8.1935; 7.709; 5.408; 90; 90; 90;

COD ID: 2102118

Formula: - O7 P2 Zr -
Comments: Krogh Andersen, Anne Marie; Norby, Poul Ab initio structure determination and Rietveld refinement of a high-temperature phase of zirconium hydrogen phosphate and a new polymorph of zirconium pyrophosphate from in situ temperature-resolved powder diffraction data Acta Crystallographica Section B 56(4) (2000) 618-625
Space group: P n n m
Cell volume: 294.74
Cell parameters: 8.3127; 6.6389; 5.3407; 90; 90; 90;

COD ID: 2104022
CIF file Original IUCr paper	Formula: - Ge O2 - Comments: Shiraki, Koichi; Tsuchiya, Taku; Ono, Shigeaki Structural refinements of high-pressure phases in germanium dioxide Acta Crystallographica Section B 59(6) (2003) 701-708 Space group: P n n m Cell volume: 50.077 Cell parameters: 4.2499; 4.2024; 2.8039; 90; 90; 90;

COD ID: 2106339
CIF file	Formula: - In4 Te3 - Comments: Hogg, J.H.C.; Sutherland, H.H. The crystal structure of tetraindium tritelluride Acta Crystallographica B (24,1968-38,1982) 29 (1973) 2483-2488 Space group: P n n m Cell volume: 885.43 Cell parameters: 15.63; 12.756; 4.441; 90; 90; 90;

COD ID: 2106378
CIF file	Formula: - Br2 Cd H8 O4 - Comments: Leligny, H.; Monier, J.C. Structure cristalline de Cd Br2 (H2 O)4 Acta Crystallographica B (24,1968-38,1982) 34 (1978) 5-8 Space group: P n n m Cell volume: 380.579 Cell parameters: 12.594; 7.551; 4.002; 90; 90; 90;

COD ID: 2106396
CIF file	Formula: - In S6 Sm3 - Comments: Messain, D.; Carre, D.; Laruelle, P. Structure cristalline du sulfure de samarium et d'indium Sm3 In S6 Acta Crystallographica B (24,1968-38,1982) 33 (1977) 2540-2542 Space group: P n n m Cell volume: 878.135 Cell parameters: 16.513; 13.632; 3.901; 90; 90; 90;

COD ID: 2106438
CIF file	Formula: - Br2 H2 I K O - Comments: Soled, S.; Carpenter, G.B. The Crystal Structure of K I Br2 (H2 O) Acta Crystallographica B (24,1968-38,1982) 29 (1973) 2556-2559 Space group: P n n m Cell volume: 697.744 Cell parameters: 12.183; 13.046; 4.39; 90; 90; 90;

COD ID: 2106563
CIF file	Formula: - Co2 Y3 - Comments: Moreau, J.M.; Paccard, D.; Parthe, E. The orthorombic structure of Y3 Co2, a shift structure variation of the monoclinic Dy3Ni2-type Acta Crystallographica B (24,1968-38,1982) 31 (1975) 747-749 Space group: P n n m Cell volume: 457.111 Cell parameters: 12.248; 9.389; 3.975; 90; 90; 90;

COD ID: 2106679
CIF file	Formula: - C4 H30 Co2 N14 O2 S4 - Comments: Fronczek, F.R.; Schaefer, W.P.; Marsh, R.E. A reinvestigation of the crystal structure of decaammine mue-peroxodicobalt tetrathiocyanate Acta Crystallographica B (24,1968-38,1982) 30 (1974) 117-121 Space group: P n n m Cell volume: 1113.78 Cell parameters: 13.266; 10.574; 7.94; 90; 90; 90;

COD ID: 2107069
CIF file	Formula: - Se Zr2 - Comments: Franzen, H.F.; Norrby, L.J. The crystal structure of Zr2 Se Acta Crystallographica B (24,1968-38,1982) 24 (1968) 601-603 Space group: P n n m Cell volume: 719.137 Cell parameters: 15.7968; 12.64; 3.6016; 90; 90; 90;

COD ID: 2201017
CIF file	Formula: - Ba2 Cl2 Co O6 Se2 - Comments: Johnston, Magnus G.; Harrison, William T. A. Barium cobalt chloride selenite, Ba~2~CoCl~2~(SeO~3~)~2~ Acta Crystallographica, Section E 58 (2002) i49-i51 Space group: P n n m Cell volume: 460.7 Cell parameters: 6.7635; 12.6454; 5.3866; 90; 90; 90;

COD ID: 2202751
CIF file Original IUCr paper	Formula: - C6 H4 Ge N2 O2 S2 - Comments: Sema Öztürk; Mehmet Akkurt; Tevfik Rıza Kök; Hoong-Kun Fun 2,2-Dimethoxy-1,3,2-dithiagermole-4,5-dicarbonitrile Acta Crystallographica Section E 59(11) (2003) m1018-m1019 Space group: P n n m Cell volume: 1193.41 Cell parameters: 12.296; 9.7463; 9.9583; 90; 90; 90;

COD ID: 2205074

Formula: - C17 H15 Cl3 N2 Ni O2 -
Comments: Cheng, Xiao-Li; Gao, Shan; Huo, Li-Hua; Ng, Seik Weng [N,N'-Ethylenebis(salicylideneiminato)]nickel(II) chloroform solvate Acta Crystallographica Section E 61(2) (2005) m385-m386
Space group: P n n m
Cell volume: 1826.4
Cell parameters: 6.997; 14.221; 18.355; 90; 90; 90;

COD ID: 2205222
CIF file Original IUCr paper	Formula: - C6 H24 N4 O9 S2 - Comments: Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng Triethylenetetraminium(4+) bis(sulfate) monohydrate Acta Crystallographica Section E 61(3) (2005) o774-o775 Space group: P n n m Cell volume: 772.05 Cell parameters: 6.3192; 22.253; 5.4903; 90; 90; 90;

COD ID: 2207104

Formula: - C14 H14 N2 Ni O4 -
Comments: Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng The ribbon structure of nickel(II) acetate‒4,4'-bipyridine Acta Crystallographica Section E 61(10) (2005) m1897-m1899
Space group: P n n m
Cell volume: 1404.9
Cell parameters: 11.278; 11.532; 10.802; 90; 90; 90;

COD ID: 2212013

Formula: - B2 Cd3 O6 -
Comments: Zhao, Ying-Hua; Chen, Xue-An; Chang, Xin-An; Zuo, Jian-Long; Li, Ming Tricadmium bis(borate), Cd~3~(BO~3~)~2~ Acta Crystallographica Section E 63(2) (2007) i50-i52
Space group: P n n m
Cell volume: 257.41
Cell parameters: 5.968; 4.786; 9.012; 90; 90; 90;

COD ID: 2216418

Formula: - C19 H19 N7 Ni O6 S -
Comments: Fu-Min Wang [6-Phenyl-2,4-bis(2-pyridylamino)-1,3,5-triazine]sulfatonickel(II) dihydrate Acta Crystallographica Section E 63(12) (2007) m2996-m2997
Space group: P n n m
Cell volume: 2224.5
Cell parameters: 15.912; 11.4246; 12.237; 90; 90; 90;

COD ID: 2218027

Formula: - C12 H28 Cl6 N2 Sn -
Comments: Shahzadi, Saira; Khan, Hamid Nawaz; Ali, Saqib; Helliwell, Madeleine Bis(4-methylpiperidinium) hexachloridostannate(IV) Acta Crystallographica Section E 64(4) (2008) m573
Space group: P n n m
Cell volume: 1064
Cell parameters: 13.123; 7.722; 10.5; 90; 90; 90;

COD ID: 2219402

Formula: - As1.99 Co0.61 Fe0.17 Ni0.22 S0.01 -
Comments: Yang, Hexiong; Downs, Robert T.; Eichler, Carla Safflorite, (Co,Ni,Fe)As~2~, isomorphous with marcasite Acta Crystallographica Section E 64(9) (2008) i62
Space group: P n n m
Cell volume: 93.29
Cell parameters: 5.0669; 5.8739; 3.1346; 90; 90; 90;

COD ID: 2221179

Formula: - C3 H5 K N2 O5 -
Comments: Zhang, Lian-Feng Potassium oxalurate monohydrate Acta Crystallographica Section E 65(3) (2009) m308-m309
Space group: P n n m
Cell volume: 685.9
Cell parameters: 7.7313; 12.799; 6.9313; 90; 90; 90;

COD ID: 2225624

Formula: - C26 H22 Cl2 Cu2 F4 N12 O10 -
Comments: Luo, Zhi-Rong; Hu, Fei-Long; Zhuang, Yue; Yin, Xian-Hong; Wu, Qiao-Lan Bis[μ-2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-olato]dicopper(II) bis(perchlorate) Acta Crystallographica Section E 66(4) (2010) m391
Space group: P n n m
Cell volume: 1749.4
Cell parameters: 15.4464; 7.9532; 14.2407; 90; 90; 90;

COD ID: 2232985

Formula: - As H Mn2 O5 -
Comments: Yang, Yongbo W.; Stevenson, Ryan A.; Siegel, Alesha M.; Downs, Gordon W. Redetermination of eveite, Mn~2~AsO~4~(OH), based on single-crystal X-ray diffraction data Acta Crystallographica Section E 67(12) (2011) i68-i68
Space group: P n n m
Cell volume: 469.33
Cell parameters: 8.5478; 8.7207; 6.2961; 90; 90; 90;

COD ID: 2233311

Formula: - Cs3 Se12 Sm7 -
Comments: Schneck, Christof; Elbe, Andreas; Schurz, Christian M.; Schleid, Thomas Cs~3~Sm~7~Se~12~ Acta Crystallographica Section E 68(1) (2012) i2
Space group: P n n m
Cell volume: 1472.95
Cell parameters: 13.0387; 26.6742; 4.2351; 90; 90; 90;

COD ID: 2234693

Formula: - C17 H22 Ce N O12 -
Comments: Kumagai, Hitoshi; Sakamoto, Yoshiyuki; Kawata, Satoshi; Inagaki, Shinji Poly[[dodecaaqua(μ~4~-benzene-1,4-dicarboxylato)(μ~2~-4,4'-bipyridine-κ^2^N:N')dicerium(III)] bis(benzene-1,4-dicarboxylate)] Acta Crystallographica Section E 68(5) (2012) m643-m644
Space group: P n n m
Cell volume: 1954
Cell parameters: 6.112; 14.278; 22.395; 90; 90; 90;

COD ID: 2234733

Formula: - C22 H52 Cl6 N2 O2 S4 Sn6 -
Comments: Rodríguez, Nicolás; Brandão, Pedro F. B.; Okio, Coco K. Y. A. Di-μ~2~-chlorido-dichloridooctamethyldi-μ~3~-oxido-tetratin(IV) bis[chloridodimethyl(pyrrolidine-1-carbodithioato-κ^2^S,S')tin(IV)] Acta Crystallographica Section E 68(5) (2012) m672
Space group: P n n m
Cell volume: 2299.01
Cell parameters: 14.5262; 14.6086; 10.8338; 90; 90; 90;

COD ID: 2238079

Formula: - C12 H32 Cl10 N4 O2 Sb2 -
Comments: Ben Rhaiem, Tarek; Boughzala, Habib; Driss, Ahmed Bis(1,4-diazoniabicyclo[2.2.2]octane) di-μ-chlorido-bis[tetrachloridoantimonate(III)] dihydrate Acta Crystallographica Section E 69(6) (2013) m330
Space group: P n n m
Cell volume: 1446.6
Cell parameters: 9.162; 20.869; 7.566; 90; 90; 90;

COD ID: 2239824

Formula: - Al6 O11 Pb0.35 Sr1.65 -
Comments: Weil, Matthias Crystal structure of the solid solution (Sr~1.65~Pb~0.35~)Al~6~O~11~ Acta Crystallographica Section E 70(9) (2014) i45
Space group: P n n m
Cell volume: 903.03
Cell parameters: 22.0299; 4.8802; 8.3995; 90; 90; 90;

COD ID: 2241623

Formula: - C16 H26 Co N2 O4 -
Comments: Dumitru, Florina; Englert, Ulli; Braun, Beatrice Orientational disorder in the one-dimensional coordination polymer catena-poly[[bis(acetylacetonato-κ^2^O,O')cobalt(II)]-μ-1,4-diazabicyclo[2.2.2]octane-κ^2^N^1^:N^4^] Acta Crystallographica Section E 72(4) (2016) 548-551
Space group: P n n m
Cell volume: 849.28
Cell parameters: 7.7468; 15.1573; 7.2328; 90; 90; 90;

COD ID: 2242026

Formula: - C20 H26 Fe N8 O2 -
Comments: Tanaka, Rikako; Matsushita, Nobuyuki Crystal structure of bis(1-ethylpyridinium) dioxonium hexacyanidoferrate(II) Acta Crystallographica Section E 73(2) (2017) 219-222
Space group: P n n m
Cell volume: 1209.79
Cell parameters: 11.8807; 12.1279; 8.3962; 90; 90; 90;

COD ID: 2244157

Formula: - B12 H10 O26 Rb6 -
Comments: Qiu, Qi-Ming; Yan, Li; Song, Jian-Biao Crystal structure of Rb~6~[B~12~O~18~(OH)~6~]·2H~2~O Acta Crystallographica Section E 78(10) (2022) 971-973
Space group: P n n m
Cell volume: 1532.6
Cell parameters: 13.395; 9.251; 12.368; 90; 90; 90;

COD ID: 2310329
CIF file	Formula: - Al2 O5 Si - Comments: Oganov, A. P.; Price, G. D.; Brodholt, J. P. Theoretical investigation of metastable Al~2~SiO~5~ polymorphs Acta Crystallographica Section A 57(5) (2001) 548-557 Space group: P n n m Cell volume: 336.196 Cell parameters: 7.679; 7.727; 5.666; 90; 90; 90;

COD ID: 2310457
CIF file	Formula: - S Ti2 - Comments: Owens, J.P.; Conard, B.R.; Franzen, H.F. The crystal structure of Ti2 S Acta Crystallographica (1,1948-23,1967) 23 (1967) 77-82 Space group: P n n m Cell volume: 529.809 Cell parameters: 11.35; 14.06; 3.32; 90; 90; 90;

COD ID: 2310476
CIF file	Formula: - Cl2 Cr - Comments: Rundle, R.E.; Scheringer, C. The crystal structure of chromium(II) chloride Acta Crystallographica (1,1948-23,1967) 14 (1961) 927-929 Space group: P n n m Cell volume: 137.256 Cell parameters: 6.621; 5.957; 3.48; 90; 90; 90;

COD ID: 2310689
CIF file	Formula: - C4 H30 Co2 N14 O2 S4 - Comments: Vannerberg, N.I. The Crystal Structure of Decammine-mue-peroxodicobalt(III) Tetrathiocyanate Acta Crystallographica (1,1948-23,1967) 18 (1965) 449-453 Space group: P n n m Cell volume: 1102.16 Cell parameters: 13.22; 10.58; 7.88; 90; 90; 90;

COD ID: 2310708
CIF file	Formula: - Se Ti2 - Comments: Albe, K.; Weirich, T. E. Structure and stability of α- and β-Ti~2~Se. Electron diffraction versus density-functional theory calculations Acta Crystallographica Section A 59(1) (2003) 18-21 Space group: P n n m Cell volume: 589.785 Cell parameters: 11.752; 14.534; 3.453; 90; 90; 90;

COD ID: 2311663

Formula: - C5 H4 Fe N6 Na2 O3 -
Comments: Wenger, Emmanuel; Dahaoui, Slimane; Alle, Paul; Parois, Pascal; Palin, Cyril; Lecomte, Claude; Schaniel, Dominik XPAD X-ray hybrid pixel detector for charge density quality diffracted intensities on laboratory equipment. Acta crystallographica Section B, Structural science, crystal engineering and materials 70(Pt 5) (2014) 783-791
Space group: P n n m
Cell volume: 1131.19
Cell parameters: 6.14102; 11.8451; 15.5509; 90; 90; 90;

COD ID: 2311987

Formula: - C10 H10 Au2 I2 N2 -
Comments: Döring, Cindy; Sui, Zhihong; Jones, Peter G. 3,4-Lutidinium salts with the diiodidoaurate(I) anion: structure of [(3,4-lut)2H]+·[AuI2]- and of two polymorphs of [(3,4-lut)2H+]2·[AuI2]-·I. Acta crystallographica. Section C, Structural chemistry 74(Pt 3) (2018) 289-294
Space group: P n n m
Cell volume: 1505.62
Cell parameters: 7.1692; 14.2434; 14.7445; 90; 90; 90;

COD ID: 4000191
CIF file	Formula: - C6 H60 K2 N6 O30 S8 W6 Zn2 - Comments: Jin, Song; DiSalvo, Francis J. 3-D Coordination Network Structures Constructed from [W6S8(CN)6]6- Anions Chemistry of Materials (2002) Space group: P n n m Cell volume: 2929.2 Cell parameters: 15.693; 16.914; 11.0355; 90; 90; 90;

COD ID: 4000192
CIF file	Formula: - Bi4.6 Ca1.1 O10.5 V - Comments: Radosavljevic Evans, Ivana; Tao, Shanwen; Irvine, John T. S.; Howard, Judith A. K. Synthesis, Crystal Structure, and Oxide Ion Conductivity in Bi~4.6~Ca~1.1~VO~10.5~ Chemistry of Materials 14(9) (2002) 3700-3704 Space group: P n n m Cell volume: 2199.2 Cell parameters: 11.93; 16.03; 11.5; 90; 90; 90;

COD ID: 4002022
CIF file	Formula: - Al7 Ba4.75 Eu0.25 N25 Si11 - Comments: Hirosaki, Naoto; Takeda, Takashi; Funahashi, Shiro; Xie, Rong-Jun Discovery of New Nitridosilicate Phosphors for Solid State Lighting by the Single-Particle-Diagnosis Approach Chemistry of Materials 26(14) (2014) 4280 Space group: P n n m Cell volume: 1208.86 Cell parameters: 9.5928; 21.3991; 5.8889; 90; 90; 90;

COD ID: 4002928

Formula: - As6 Ge6 K4 -
Comments: Eulenstein, Armin R.; Bogdanovski, Dimitri; Reinhardt, Hendrik; Miß, Vanessa; Roling, Bernhard; Hampp, Norbert; Dronskowski, Richard; Dehnen, Stefanie K2Ge3As3: Fiberlike Crystals of a Narrow-Band-Gap Zintl Phase with a One-Dimensional Substructure ∞1{(Ge3As3)2‒} Chemistry of Materials (2019)
Space group: P n n m
Cell volume: 864.47
Cell parameters: 14.1466; 16.3002; 3.7489; 90; 90; 90;

COD ID: 4003239
CIF file	Formula: - C8 H26 I8 N4 O2 Pb3 - Comments: Umeyama, Daiki; Lin, Yu; Karunadasa, Hemamala I. Red-to-Black Piezochromism in a Compressible Pb‒I‒SCN Layered Perovskite Chemistry of Materials 28(10) (2016) 3241 Space group: P n n m Cell volume: 1700.31 Cell parameters: 17.1512; 21.8564; 4.5358; 90; 90; 90;

COD ID: 4003560

Formula: - In2 Li O6 Sb -
Comments: Flynn, Steven; Sanghvi, Sheel; Nisbet, Matthew L.; Griffith, Kent J.; Zhang, Weiguo; Halasyamani, P. Shiv; Haile, Sossina M.; Poeppelmeier, Kenneth R. LiIn2SbO6: A New Rutile-Related Structure Type with Unique Ion Channels Chemistry of Materials (2020)
Space group: P n n m
Cell volume: 241.14
Cell parameters: 5.0991; 5.3298; 8.8729; 90; 90; 90;

COD ID: 4003561

Formula: - In2 Li O6 Sb -
Comments: Flynn, Steven; Sanghvi, Sheel; Nisbet, Matthew L.; Griffith, Kent J.; Zhang, Weiguo; Halasyamani, P. Shiv; Haile, Sossina M.; Poeppelmeier, Kenneth R. LiIn2SbO6: A New Rutile-Related Structure Type with Unique Ion Channels Chemistry of Materials (2020)
Space group: P n n m
Cell volume: 242.33
Cell parameters: 5.117; 5.3335; 8.8794; 90; 90; 90;

COD ID: 4003562

Formula: - In2 Li O6 Sb -
Comments: Flynn, Steven; Sanghvi, Sheel; Nisbet, Matthew L.; Griffith, Kent J.; Zhang, Weiguo; Halasyamani, P. Shiv; Haile, Sossina M.; Poeppelmeier, Kenneth R. LiIn2SbO6: A New Rutile-Related Structure Type with Unique Ion Channels Chemistry of Materials (2020)
Space group: P n n m
Cell volume: 241.08
Cell parameters: 5.0902; 5.3328; 8.8813; 90; 90; 90;

COD ID: 4021113

Formula: - C20 H12 N2 -
Comments: Ken-Tsung Wong; Fu-Chuan Fang; Yi-Ming Cheng; Pi-Tai Chou; Gene-Hsiang Lee; Yu Wang A New Series of Pyrimidine-Containing Linear Molecules: Their Elegant Crystal Structures and Intriguing Photophysical Properties Journal of Organic Chemistry 69 (2004) 8038-8044
Space group: P n n m
Cell volume: 718.45
Cell parameters: 14.7183; 4.8658; 10.0319; 90; 90; 90;

COD ID: 4023021

Formula: - C48 H38 Cl4 -
Comments: Moloy Banerjee; Susanna J. Emond; Sergey V. Lindeman; Rajendra Rathore Practical Synthesis of Unsymmetrical Tetraarylethylenes and Their Application for the Preparation of [Triphenylethylene-Spacer-Triphenylethylene] Triads Journal of Organic Chemistry 72 (2007) 8054-8061
Space group: P n n m
Cell volume: 1948.23
Cell parameters: 5.8309; 15.9227; 20.984; 90; 90; 90;

COD ID: 4031227
CIF file	Formula: - Br2 Ca - Comments: Brackett, E.B.; Brackett, T.E.; Sass, R.L. The crystal structure of calcium bromide Journal of Inorganic and Nuclear Chemistry 25 (1963) 1295-1296 Space group: P n n m Cell volume: 196.426 Cell parameters: 6.584; 6.871; 4.342; 90; 90; 90;

COD ID: 4039022
CIF file HKL data	Formula: - C6 H14 Cl4 N4 - Comments: Johann O. E. Sosoe; Cédric Malveau; Thierry Maris; Radu Iftimie; James D. Wuest Refreshing the Legacy of Rudolf Nietzki: Benzene-1,2,4,5-tetramine and Related Compounds Journal of Organic Chemistry 88 (2023) 16302-16314 Space group: P n n m Cell volume: 572.27 Cell parameters: 8.0533; 9.6682; 7.3499; 90; 90; 90;

COD ID: 4061363

Formula: - C37 H58 Cl4 Ru3 S3 -
Comments: Shin, Richard Y. C.; Ng, Sin Yee; Tan, Geok Kheng; Koh, Lip Lin; Khoo, Soo Beng; Goh, Lai Yoong; Webster, Richard Syntheses and X-ray Crystal Structures of Di- and Tri-Nuclear Trithiolate/thioether Bridged Complexes of Ruthenium . Electrochemistry of Mixed Valence Triruthenium Complexes. Organometallics 23(3) (2004) 547-558
Space group: P n n m
Cell volume: 4128.9
Cell parameters: 14.4849; 16.526; 17.2483; 90; 90; 90;

COD ID: 4065631
CIF file	Formula: - C35 H36 F6 N8 O6 Pd S2 - Comments: Xiao, Xu-Qiong; Jia, Ai-Quan; Lin, Yue-Jian; Jin, Guo-Xin Self-Assembly of Palladium-Based Macrocycles with N-Heterocyclic Carbene as the “Corner” Ligand† Organometallics 29(21) (2010) 4842 Space group: P n n m Cell volume: 4856 Cell parameters: 19.935; 12.762; 19.086; 90; 90; 90;

COD ID: 4066917
CIF file	Formula: - C9 H16 Mo N6 O2 - Comments: Liu, Fu-Chen; Lin, Yu-Liang; Yang, Pei-Shan; Lee, Gene-Hsian; Peng, Shie-Ming [3+2] Cycloadditions of Molybdenum(II) Azide Complexes with Nitriles and an Alkyne Organometallics 29(19) (2010) 4282 Space group: P n n m Cell volume: 1305.15 Cell parameters: 15.1003; 11.6868; 7.3957; 90; 90; 90;

COD ID: 4070804

Formula: - C55 H85 B30 Cl3 N6 Ru3 S6 -
Comments: Zhang, Jia-Sheng; Liu, Shuang; Wang, Guo-Liang; Lin, Yue-Jian; Jin, Guo-Xin Self-Assembly of Trinuclear Half-Sandwich Metal (Co and Ru) Complexes Containing Ancillaryortho-Carborane-1,2-dithiolato Ligands Organometallics 27(6) (2008) 1112
Space group: P n n m
Cell volume: 11052
Cell parameters: 20.384; 22.015; 24.629; 90; 90; 90;

COD ID: 4071099
CIF file	Formula: - C33 H42 N O P Ru2 - Comments: Takemoto, Shin; Kimura, Yu; Kamikawa, Ken; Matsuzaka, Hiroyuki P−H Bond Addition to a Dinuclear Ruthenium Imido Complex: Synthesis and Reactivity of an Amido Phosphido Complex Organometallics 27(8) (2008) 1780 Space group: P n n m Cell volume: 3165.1 Cell parameters: 13.066; 15.12; 16.021; 90; 90; 90;

COD ID: 4071838
CIF file	Formula: - C11 H15 B Mo N5 O3.5 S2 - Comments: Abernethy, Robyn J.; Foreman, Mark R. St.-J.; Hill, Anthony F.; Tshabang, Never; Willis, Anthony C.; Young, Rowan D. Poly(methimazolyl)borato Nitrosyl Complexes of Molybdenum and Tungsten Organometallics 27(17) (2008) 4455 Space group: P n n m Cell volume: 1767.07 Cell parameters: 17.4413; 6.7479; 15.0143; 90; 90; 90;

COD ID: 4074413
CIF file	Formula: - C28 H39 Cl2 N3 Ru - Comments: Hejl, Andrew; Day, Michael W.; Grubbs, Robert H. Latent Olefin Metathesis Catalysts Featuring Chelating Alkylidenes Organometallics 25(26) (2006) 6149 Space group: P n n m Cell volume: 2771.9 Cell parameters: 14.9244; 16.4672; 11.2788; 90; 90; 90;

COD ID: 4076987
CIF file	Formula: - C74 H110 Ba N8 Ti6 - Comments: Martín, Avelino; Mena, Miguel; Pérez-Redondo, Adrián; Yélamos, Carlos Titanium−Group 2 Metal Molecular Nitrides Organometallics 21(16) (2002) 3308 Space group: P n n m Cell volume: 3890.6 Cell parameters: 15.09; 15.357; 16.789; 90; 90; 90;

COD ID: 4078605

Formula: - C41.42 H60 Co N3 Ni9 O15.42 -
Comments: Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1) Organometallics 31(12) (2012) 4593
Space group: P n n m
Cell volume: 2720
Cell parameters: 12.0473; 12.2173; 18.4801; 90; 90; 90;

COD ID: 4078606

Formula: - C41.29 H60 Co N3 Ni9 O15.3 -
Comments: Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1) Organometallics 31(12) (2012) 4593
Space group: P n n m
Cell volume: 2706.9
Cell parameters: 11.997; 12.2347; 18.442; 90; 90; 90;

COD ID: 4078607

Formula: - C41.17 H60 Co N3 Ni9 O15.16 -
Comments: Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1) Organometallics 31(12) (2012) 4593
Space group: P n n m
Cell volume: 2709.2
Cell parameters: 11.996; 12.2702; 18.406; 90; 90; 90;

COD ID: 4078608

Formula: - C41.19 H60 Co N3 Ni9 O15.18 -
Comments: Ciabatti, Iacopo; Femoni, Cristina; Iapalucci, Maria Carmela; Longoni, Giuliano; Zacchini, Stefano Bimetallic Nickel‒Cobalt Hexacarbido Carbonyl Clusters [H6‒nNi22Co6C6(CO)36]n−(n= 3‒6) Possessing Polyhydride Nature and Their Base-Induced Degradation to the Monoacetylide [Ni9CoC2(CO)16‒x]3‒(x= 0, 1) Organometallics 31(12) (2012) 4593
Space group: P n n m
Cell volume: 2708.8
Cell parameters: 11.9946; 12.2638; 18.415; 90; 90; 90;

COD ID: 4084796
CIF file	Formula: - C31.5 H47 B N3 O3 Rh - Comments: Xu, Songchen; Manna, Kuntal; Ellern, Arkady; Sadow, Aaron D. Mixed N-Heterocyclic Carbene‒Bis(oxazolinyl)borato Rhodium and Iridium Complexes in Photochemical and Thermal Oxidative Addition Reactions Organometallics 33(23) (2014) 6840 Space group: P n n m Cell volume: 3216 Cell parameters: 29.675; 9.355; 11.583; 90; 90; 90;

COD ID: 4085239

Formula: - C6 H26 B22 Cs2 Hg I2 N2 -
Comments: Himmelspach, Alexander; Warneke, Jonas; Schäfer, Marius; Hailmann, Michael; Finze, Maik Salts of the Dianions [Hg(12-X-closo-1-CB11H10)2]2‒(X = I, C≡CH, C≡CFc, C≡CSiiPr3): Synthesis and Spectroscopic and Structural Characterization Organometallics 34(2) (2015) 462
Space group: P n n m
Cell volume: 1611
Cell parameters: 15.019; 10.127; 10.592; 90; 90; 90;

COD ID: 4086929
CIF file	Formula: - C22 H23 F3 N2 O8 S Si - Comments: Koch, James G.; Brennessel, William W.; Kraft, Bradley M. Neutral and Cationic Bis-Chelate Monoorganosilicon(IV) Complexes of 1-Hydroxy-2-pyridinone Organometallics 36(3) (2017) 594 Space group: P n n m Cell volume: 2481.7 Cell parameters: 26.663; 9.2503; 10.0619; 90; 90; 90;

COD ID: 4100243
CIF file	Formula: - C109 H50 N S2 Sc3 - Comments: Journal of the American Chemical Society (2005) Space group: P n n m Cell volume: 6169.2 Cell parameters: 16.0353; 25.543; 15.0618; 90; 90; 90;

COD ID: 4100976
CIF file	Formula: - C94 H167.87 I4 N54 O54.94 - Comments: Liu, Simin; Zavalij, Peter Y.; Isaacs, Lyle Cucurbit[10]uril. Journal of the American Chemical Society 127(48) (2005) 16798-16799 Space group: P n n m Cell volume: 7302 Cell parameters: 19.476; 20.192; 18.567; 90; 90; 90;

COD ID: 4102207

Formula: - C32 H44 N4 Ni O6 -
Comments: Deguang Huang; R. H. Holm Reactions of the Terminal NiII-OH Group in Substitution and Electrophilic Reactions with Carbon Dioxide and Other Substrates: Structural Definition of Binding Modes in an Intramolecular NiII...FeII Bridged Site Journal of the American Chemical Society 132 (2010) 4693-4701
Space group: P n n m
Cell volume: 3336.5
Cell parameters: 17.494; 12.92; 14.762; 90; 90; 90;

COD ID: 4105298

Formula: - Cu Se2 -
Comments: Alfred J. Wooten; Donald J. Werder; Darrick J. Williams; Joanna L. Casson; Jennifer A. Hollingsworth Solution-Liquid-Solid Growth of Ternary Cu-In-Se Semiconductor Nanowires from Multiple- and Single-Source Precursors Journal of the American Chemical Society 131 (2009) 16177-16188
Space group: P n n m
Cell volume: 116.56
Cell parameters: 5.0252; 6.1941; 3.7447; 90; 90; 90;

COD ID: 4106795

Formula: - C40 H26 Cd I2 N8 -
Comments: Lucas D. DeVries; Paul M. Barron; Evan P. Hurley; Chunhua Hu; Wonyoung Choe "Nanoscale Lattice Fence" in a Metal-Organic Framework: Interplay between Hinged Topology and Highly Anisotropic Thermal Response Journal of the American Chemical Society 133 (2011) 14848-14851
Space group: P n n m
Cell volume: 3248.5
Cell parameters: 8.7268; 18.294; 20.348; 90; 90; 90;

COD ID: 4106796

Formula: - C40 H26 Cd I2 N8 -
Comments: Lucas D. DeVries; Paul M. Barron; Evan P. Hurley; Chunhua Hu; Wonyoung Choe "Nanoscale Lattice Fence" in a Metal-Organic Framework: Interplay between Hinged Topology and Highly Anisotropic Thermal Response Journal of the American Chemical Society 133 (2011) 14848-14851
Space group: P n n m
Cell volume: 3280.1
Cell parameters: 8.8045; 18.2945; 20.364; 90; 90; 90;

COD ID: 4106797

Formula: - C40 H26 Cd I2 N8 -
Comments: Lucas D. DeVries; Paul M. Barron; Evan P. Hurley; Chunhua Hu; Wonyoung Choe "Nanoscale Lattice Fence" in a Metal-Organic Framework: Interplay between Hinged Topology and Highly Anisotropic Thermal Response Journal of the American Chemical Society 133 (2011) 14848-14851
Space group: P n n m
Cell volume: 3348.8
Cell parameters: 8.9939; 18.27; 20.38; 90; 90; 90;

COD ID: 4108062
CIF file	Formula: - C32 H42 N2 Rh2 - Comments: Shin Takemoto; Shohei Otsuki; Yasuhiro Hashimoto; Ken Kamikawa; Hiroyuki Matsuzaka Divalent Dirhodium Imido Complexes: Formation, Structure, and Alkyne Cycloaddition Reactivity Journal of the American Chemical Society 130 (2008) 8904-8905 Space group: P n n m Cell volume: 2984 Cell parameters: 12.601; 14.722; 16.085; 90; 90; 90;

COD ID: 4109473

Formula: - C48 H30 O13 Zn4 -
Comments: Christina A. Bauer; Tatiana V. Timofeeva; Thomas B. Settersten; Brian D. Patterson; Vincent H. Liu; Blake A. Simmons; Mark D. Allendorf Influence of Connectivity and Porosity on Ligand-Based Luminescence in Zinc Metal-Organic Frameworks Journal of the American Chemical Society 129 (2007) 7136-7144
Space group: P n n m
Cell volume: 14218
Cell parameters: 30.317; 19.411; 24.161; 90; 90; 90;

COD ID: 4113237
CIF file	Formula: - C118 H90 Au4 Br F12 N4 O13 P4 S4 - Comments: Ronger Lin; John H. K. Yip; Ke Zhang; Lip Lin Koh; Kwok-Yin Wong; Kam Piu Ho Self-Assembly and Molecular Recognition of a Luminescent Gold Rectangle Journal of the American Chemical Society 126 (2004) 15852-15869 Space group: P n n m Cell volume: 14047.2 Cell parameters: 27.4266; 21.6592; 23.647; 90; 90; 90;

COD ID: 4113628

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1948.8
Cell parameters: 7.4119; 14.0747; 18.681; 90; 90; 90;

COD ID: 4113629

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1951
Cell parameters: 7.4158; 14.071; 18.697; 90; 90; 90;

COD ID: 4113630

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1952.4
Cell parameters: 7.418; 14.07; 18.706; 90; 90; 90;

COD ID: 4113631

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1953
Cell parameters: 7.418; 14.068; 18.715; 90; 90; 90;

COD ID: 4113633

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1948
Cell parameters: 7.4105; 14.0764; 18.6746; 90; 90; 90;

COD ID: 4113634

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1954.7
Cell parameters: 7.421; 14.066; 18.726; 90; 90; 90;

COD ID: 4113635

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1957
Cell parameters: 7.424; 14.065; 18.743; 90; 90; 90;

COD ID: 4113636

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1959
Cell parameters: 7.426; 14.066; 18.752; 90; 90; 90;

COD ID: 4113637

Formula: - O72 Si36 -
Comments: Ivor Bull; Philip Lightfoot; Luis A. Villaescusa; Lucy M. Bull; Richard K. B. Gover; John S. O. Evans; Russell E. Morris An X-ray Diffraction and MAS NMR Study of the Thermal Expansion Properties of Calcined Siliceous Ferrierite Journal of the American Chemical Society 125 (2003) 4342-4349
Space group: P n n m
Cell volume: 1961
Cell parameters: 7.429; 14.067; 18.765; 90; 90; 90;

COD ID: 4116235

Formula: - C11 H12 B N4 O3 Re S2 -
Comments: Raquel Garcia; António Paulo; Ângela Domingos; Isabel Santos; Kirstin Ortner; Roger Alberto Re and Tc Complexes Containing B-H...M Agostic Interactions as Building Blocks for the Design of Radiopharmaceuticals Journal of the American Chemical Society 122 (2000) 11240-11241
Space group: P n n m
Cell volume: 1796
Cell parameters: 17.372; 6.8151; 15.17; 90; 90; 90;

COD ID: 4116743
CIF file	Formula: - C14 H15 B Fe O4 - Comments: Alan H. Cowley; Viviana Lomelí; Andreas Voigt Synthesis and Characterization of a Terminal Borylene (Boranediyl) Complex Journal of the American Chemical Society 120 (1998) 6401-6402 Space group: P n n m Cell volume: 1429.1 Cell parameters: 13.095; 9.663; 11.2943; 90; 90; 90;

COD ID: 4117303

Formula: - C12 H12 Ce2 O18 -
Comments: Christophe Volkringer; Natacha Henry; Stéphane Grandjean; Thierry Loiseau Uranyl and/or Rare-Earth Mellitates in Extended Organic-Inorganic Networks: A Unique Case of Heterometallic Cation-Cation Interaction with UVI=O-LnIII Bonding (Ln = Ce, Nd) Journal of the American Chemical Society 134 (2012) 1275-1283
Space group: P n n m
Cell volume: 941.6
Cell parameters: 13.5874; 6.739; 10.2833; 90; 90; 90;

COD ID: 4118071
CIF file	Formula: - C38 H30 N2 O16 P2 Zn2 - Comments: Yu-Chuan Chang; Sue-Lein Wang From Stimuli-Responsive Polymorphic Organic Dye Crystals to Photoluminescent Cationic Open-Framework Metal Phosphate Journal of the American Chemical Society 134 (2012) 9848-9851 Space group: P n n m Cell volume: 3941.1 Cell parameters: 9.2671; 17.1198; 24.8416; 90; 90; 90;

COD ID: 4119362

Formula: - Gd60 Ru9.84 Sn61.08 -
Comments: Devin C. Schmitt; Neel Haldolaarachchige; Joseph Prestigiacomo; Amar Karki; David P. Young; Shane Stadler; Rongying Jin; Julia Y. Chan Structural Complexity Meets Transport and Magnetic Anisotropy in Single Crystalline Ln30Ru4Sn31 (Ln = Gd, Dy) Journal of the American Chemical Society 135 (2013) 2748-2758
Space group: P n n m
Cell volume: 3393.5
Cell parameters: 11.784; 24.717; 11.651; 90; 90; 90;

COD ID: 4119363

Formula: - Ru12 Sn58.94 Tb60 -
Comments: Devin C. Schmitt; Neel Haldolaarachchige; Joseph Prestigiacomo; Amar Karki; David P. Young; Shane Stadler; Rongying Jin; Julia Y. Chan Structural Complexity Meets Transport and Magnetic Anisotropy in Single Crystalline Ln30Ru4Sn31 (Ln = Gd, Dy) Journal of the American Chemical Society 135 (2013) 2748-2758
Space group: P n n m
Cell volume: 3318.4
Cell parameters: 11.696; 24.505; 11.578; 90; 90; 90;

COD ID: 4119364

Formula: - Dy60 Ru9.14 Sn61.43 -
Comments: Devin C. Schmitt; Neel Haldolaarachchige; Joseph Prestigiacomo; Amar Karki; David P. Young; Shane Stadler; Rongying Jin; Julia Y. Chan Structural Complexity Meets Transport and Magnetic Anisotropy in Single Crystalline Ln30Ru4Sn31 (Ln = Gd, Dy) Journal of the American Chemical Society 135 (2013) 2748-2758
Space group: P n n m
Cell volume: 3297.4
Cell parameters: 11.659; 24.457; 11.564; 90; 90; 90;

COD ID: 4122851

Formula: - C100 H52 In3 N4 O16 -
Comments: Johnson, Jacob A.; Zhang, Xu; Reeson, Tyler C.; Chen, Yu-Sheng; Zhang, Jian Facile Control of the Charge Density and Photocatalytic Activity of an Anionic Indium Porphyrin Framework via in Situ Metalation. Journal of the American Chemical Society (2014) 141028135635006
Space group: P n n m
Cell volume: 17735
Cell parameters: 23.5482; 23.548; 31.983; 90; 90; 90;

COD ID: 4122852

Formula: - C100 H52 In3 N4 O16 -
Comments: Johnson, Jacob A.; Zhang, Xu; Reeson, Tyler C.; Chen, Yu-Sheng; Zhang, Jian Facile Control of the Charge Density and Photocatalytic Activity of an Anionic Indium Porphyrin Framework via in Situ Metalation. Journal of the American Chemical Society (2014) 141028135635006
Space group: P n n m
Cell volume: 16453
Cell parameters: 23.881; 23.915; 28.808; 90; 90; 90;

COD ID: 4124631
CIF file	Formula: - Na O2 - Comments: Carter, G.F.; Templeton, D.H. Polymorphism of sodium superoxide Journal of the American Chemical Society 75 (1953) 5247-5249 Space group: P n n m Cell volume: 81.185 Cell parameters: 4.26; 5.54; 3.44; 90; 90; 90;

COD ID: 4127072
CIF file	Formula: - C19 H22 Co N4 Na O4 - Comments: Du, Hao-Yi; Chen, Si-Cong; Su, Xiao-Jun; Jiao, Lei; Zhang, Ming-Tian Redox-Active Ligand Assisted Multielectron Catalysis: A Case of CoIII Complex as Water Oxidation Catalyst. Journal of the American Chemical Society (2018) Space group: P n n m Cell volume: 2205.1 Cell parameters: 11.408; 12.659; 15.269; 90; 90; 90;

COD ID: 4127790

Formula: - C56 H32 As8 Ba8 O78 Pd13 -
Comments: Bhattacharya, Saurav; Ayass, Wassim W.; Taffa, Dereje H.; Schneemann, Andreas; Semrau, A. Lisa; Wannapaiboon, Suttipong; Altmann, Philipp J.; Pöthig, Alexander; Nisar, Talha; Balster, Torsten; Burtch, Nicholas C.; Wagner, Veit; Fischer, Roland A.; Wark, Michael; Kortz, Ulrich Discovery of Polyoxo-Noble-Metalate-Based Metal-Organic Frameworks. Journal of the American Chemical Society 141(8) (2019) 3385-3389
Space group: P n n m
Cell volume: 9458.2
Cell parameters: 16.8628; 20.1743; 27.8022; 90; 90; 90;

COD ID: 4128907

Formula: - C32 H16 N8 O16 Zr3 -
Comments: Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society 141(34) (2019) 13654-13663
Space group: P n n m
Cell volume: 14120
Cell parameters: 30.977; 20.52; 22.213; 90; 90; 90;

COD ID: 4128908

Formula: - C64 Cl22 N16 Ni14 O47 Zr6 -
Comments: Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society 141(34) (2019) 13654-13663
Space group: P n n m
Cell volume: 13583.6
Cell parameters: 31.4535; 19.638; 21.9912; 90; 90; 90;

COD ID: 4128909

Formula: - C32 H16 Br5 N8 Ni3 O26 Zr3 -
Comments: Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society 141(34) (2019) 13654-13663
Space group: P n n m
Cell volume: 12996
Cell parameters: 31.698; 18.59; 22.055; 90; 90; 90;

COD ID: 4128910

Formula: - C32 H16 N8 O16 Zr3 -
Comments: Wang, Xiao-Ning; Zhang, Peng; Kirchon, Angelo; Li, Jia-Luo; Chen, Wen-Miao; Zhao, Yu-Meng; Li, Bao; Zhou, Hong-Cai Crystallographic Visualization of Postsynthetic Nickel Clusters into Metal-Organic Framework. Journal of the American Chemical Society 141(34) (2019) 13654-13663
Space group: P n n m
Cell volume: 13878
Cell parameters: 31.368; 19.703; 22.4548; 90; 90; 90;

COD ID: 4130648

Formula: - C100 H52 In2 Mn N4 O17 -
Comments: Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society 138(32) (2016) 10293-10298
Space group: P n n m
Cell volume: 17648.7
Cell parameters: 23.4939; 23.4954; 31.9724; 90; 90; 90;

COD ID: 4130649

Formula: - C100 H52 Fe In2 N4 O17 -
Comments: Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society 138(32) (2016) 10293-10298
Space group: P n n m
Cell volume: 17636.8
Cell parameters: 23.4897; 23.4895; 31.9645; 90; 90; 90;

COD ID: 4130651

Formula: - C100 H52 Cl In2 Mn N4 O16 -
Comments: Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society 138(32) (2016) 10293-10298
Space group: P n n m
Cell volume: 16641
Cell parameters: 23.767; 23.767; 29.459; 90; 90; 90;

COD ID: 4130653

Formula: - C100 H52 Cl Fe In2 N4 O16 -
Comments: Johnson, Jacob A.; Petersen, Brenna M.; Kormos, Attila; Echeverría, Elena; Chen, Yu-Sheng; Zhang, Jian A New Approach to Non-Coordinating Anions: Lewis Acid Enhancement of Porphyrin Metal Centers in a Zwitterionic Metal-Organic Framework. Journal of the American Chemical Society 138(32) (2016) 10293-10298
Space group: P n n m
Cell volume: 17611
Cell parameters: 23.412; 23.428; 32.108; 90; 90; 90;

COD ID: 4133597

Formula: - C282 H0 Cu24 N10 O150 -
Comments: Lal, Garima; Derakhshandeh, Maziar; Akhtar, Farid; Spasyuk, Denis M.; Lin, Jian-Bin; Trifkovic, Milana; Shimizu, George K. H. Mechanical Properties of a Metal-Organic Framework formed by Covalent Cross-Linking of Metal-Organic Polyhedra. Journal of the American Chemical Society 141(2) (2019) 1045-1053
Space group: P n n m
Cell volume: 30340
Cell parameters: 41.66; 23.73; 30.69; 90; 90; 90;

COD ID: 4301420
CIF file	Formula: - Cr Er3 S6 - Comments: Paz Vaqueiro; Iwona Szkoda; Rodolfo D. Sanchez; Anthony V. Powell Ternary Erbium Chromium Sulfides: Structural Relationships and Magnetic Properties Inorganic Chemistry 48 (2009) 1284-1292 Space group: P n n m Cell volume: 779.1 Cell parameters: 13.192; 15.819; 3.7333; 90; 90; 90;

COD ID: 4302240