Crystallography Open Database

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Searching space group like 'P 1 1 21/b'

COD ID: 1007239
CIF file	Formula: - O14 P5 Sm - Comments: Tranqui, D; Bagieu, M; Durif, A Structure cristalline de l'ultraphosphate de Samarium Sm P5 O14 Acta Crystallographica B (24,1968-38,1982) 30 (1974) 1751-1755 Space group: P 1 1 21/b Cell volume: 1016.6 Cell parameters: 8.75; 12.99; 8.944; 90; 90; 90.45;

COD ID: 1008046

CIF file

Formula: - Co3 O8 P2 -
Comments: Berthet, G; Joubert, J C; Bertaut, E F Vacancies ordering in new metastable orthophosphates (Co~3~ ) P~2~ O~8~ and (Mg~3~ ) P~2~ O~8~ with olivin-related structure Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 136 (1972) 98-105
Space group: P 1 1 21/b
Cell volume: 290.5
Cell parameters: 5.92; 10.334; 4.75; 90; 90; 91.07;

COD ID: 1008830

CIF file

Formula: - Mg3 O8 P2 -
Comments: Berthet, G; Joubert, J C; Bertaut, E F Vacancies ordering in new metastable orthophosphates (Co3 ) P2 O8 and (Mg3 ) P2 O8 with olivin-related structure Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 136 (1972) 98-105
Space group: P 1 1 21/b
Cell volume: 285.8
Cell parameters: 5.911; 10.214; 4.734; 90; 90; 90.99;

COD ID: 1510841
CIF file	Formula: - B2 Ca Mn O5 - Comments: Belov, N.V.; Simonov, M.A.; Yakubovich, O.V. The crystal structure of the synthetic Mn-Kurchatovite Ca Mn (B2 O5) Doklady Akademii Nauk SSSR 238 (1978) 98-100 Space group: P 1 1 21/b Cell volume: 784.721 Cell parameters: 12.455; 5.643; 11.43; 90; 90; 77.64;

COD ID: 1510917
CIF file	Formula: - B3 Ho Li6 O9 - Comments: Mamedov, Kh.S.; Dzhafarov, G.G.; Abdullaev, G.K.; Guseinova, S.A.; Rza-Zade, P.F. Synthesis and structural study of lithium and holmium double orthoborate crystals Zhurnal Neorganicheskoi Khimii 22 (1977) 3239-3242 Space group: P 1 1 21/b Cell volume: 756.939 Cell parameters: 7.17; 6.64; 16.46; 90; 90; 105;

COD ID: 1510934
CIF file	Formula: - B3 Li6 O9 Yb - Comments: Mamedov, H.S.; Abdullaev, G.K. Crystal structure of the double lithium ytterbium orthoborate Li6 Yb (B O3)3 Kristallografiya 22 (1977) 389-392 Space group: P 1 1 21/b Cell volume: 737.763 Cell parameters: 7.115; 6.578; 16.324; 90; 90; 105.06;

COD ID: 1521034
CIF file	Formula: - Ca9.576 Dy0.212 H2 Na0.212 O26 P6 - Comments: Fleet, M.E.; Liu, X.-Y.; Pan, Y.-M. Rare-earth elements in chlorapatite (Ca10 (P O4)6 Cl2): uptake, site preference, and degradation of monoclinic structure American Mineralogist 85 (2000) 1437-1446 Space group: P 1 1 21/b Cell volume: 1056.84 Cell parameters: 9.4179; 18.8357; 6.8793; 90; 90; 120;

COD ID: 1526137
CIF file	Formula: - Dy Gd4 Ge2 Si2 - Comments: Nirmala, R.; Sankaranarayanan, V.; Sethupathi, K.; Morozkin, A.V. Magnetism in Dy Gd4 Si2 Ge2 Journal of Alloys Compd. 326 (2001) 174-176 Space group: P 1 1 21/b Cell volume: 865.393 Cell parameters: 14.764; 7.561; 7.763; 90; 90; 93.01;

COD ID: 1527615
CIF file	Formula: - I3 Li2 O9 Rb - Comments: Kalinin, V.P.; Karataeva, I.M.; Vinogradov, E.E.; Vavilin, V.I.; Plyukhin, V.V.; Pakhomov, V.I. Crystal structure of Rb I O3 (Li I O3)2 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 4 (1978) 444-447 Space group: P 1 1 21/b Cell volume: 976.024 Cell parameters: 8.46; 11.22; 11.09; 90; 90; 112;

COD ID: 1528062

CIF file

Formula: - H8 I O9 Sm -
Comments: Shamrai, N.B.; Varfolomeev, M.B.; Saf'yanov, Yu.N.; Plyukhin, V.V.; Kuz'min, E.A. Structure of periodates of the rare-earth elements Ln I O5 (H2 O)4 (Ln = Pr-Lu And Y) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 3 (1977) 1588-1593
Space group: P 1 1 21/b
Cell volume: 725.819
Cell parameters: 7.57; 10.472; 10.392; 90; 90; 118.23;

COD ID: 1528063

CIF file

Formula: - H8 Ho I O9 -
Comments: Shamrai, N.B.; Varfolomeev, M.B.; Plyukhin, V.V.; Kuz'min, E.A.; Saf'yanov, Yu.N. Structure of periodates of the rare-earth elements Ln I O5 (H2 O)4 (Ln = Pr-Lu And Y) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 3 (1977) 1588-1593
Space group: P 1 1 21/b
Cell volume: 705.186
Cell parameters: 7.516; 10.408; 10.249; 90; 90; 118.41;

COD ID: 1528064

CIF file

Formula: - H8 I O9 Yb -
Comments: Shamrai, N.B.; Plyukhin, V.V.; Saf'yanov, Yu.N.; Varfolomeev, M.B.; Kuz'min, E.A. Structure of periodates of the rare-earth elements Ln I O5 (H2 O)4 (Ln = Pr-Lu And Y) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 3 (1977) 1588-1593
Space group: P 1 1 21/b
Cell volume: 691.664
Cell parameters: 7.457; 10.351; 10.212; 90; 90; 118.66;

COD ID: 1530120
CIF file	Formula: - I3 Li2 O9 Rb - Comments: Kalinin, V.R.; Belov, N.V.; Ilyukhin, V.V. Refinment of crystal structure of mixed rubidium-lithium iodate Rb I O3 * 2 Li I O3 Doklady Akademii Nauk SSSR 241 (1978) 583-585 Space group: P 1 1 21/b Cell volume: 972.69 Cell parameters: 8.333; 11.292; 11.121; 90; 90; 111.64;

COD ID: 1530158
CIF file	Formula: - Cl5 H12 N3 O3 Ru - Comments: Khodashova, T.S.; Bokii, G.B.; Porai-Koshits, M.A.; Sergienko, V.S.; Parpiev, N.A. Refinement of composition and structure of hydrolyzed ammonium nitroso penta chloro ruthenate Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 13 (1972) 1105-1109 Space group: P 1 1 21/b Cell volume: 1162.5 Cell parameters: 11.26; 15.74; 6.76; 90; 90; 104;

COD ID: 1530191
CIF file	Formula: - H6 O8 Se2 Zn - Comments: Kondrashev, Yu.D.; Nozik, Yu.Z.; Shibanova, T.A.; Fykin, L.E. Neutron-diffraction investigation of the crystal structure of acid zinc selenite dihydrate Zn (H Se O3)2 (H2 O)2 Kristallografiya 24 (1979) 586-589 Space group: P 1 1 21/b Cell volume: 364.767 Cell parameters: 7.155; 8.434; 6.888; 90; 90; 61.35;

COD ID: 1530453
CIF file	Formula: - H8 In K O12 S2 - Comments: Mukhtarova, N.N.; Rastsvetaeva, R.K.; Ilyukhin, V.V.; Belov, N.V. Crystal structure of K In (S O4)2 (H2 O)4 Doklady Akademii Nauk SSSR 245 (1979) 589-593 Space group: P 1 1 21/b Cell volume: 1015.39 Cell parameters: 10.606; 9.231; 10.654; 90; 90; 103.23;

COD ID: 1530454
CIF file	Formula: - H8 In O12 Rb S2 - Comments: Mukhtarova, N.N.; Rastsvetaeva, R.K.; Ilyukhin, V.V.; Belov, N.V. Refinement of the crystal structure of Rb In (S O4)2 (H2 O)4 Doklady Akademii Nauk SSSR 247 (1979) 600-603 Space group: P 1 1 21/b Cell volume: 1035.26 Cell parameters: 10.645; 9.277; 10.739; 90; 90; 102.53;

COD ID: 1530484
CIF file	Formula: - Ca5 Ge2 H2 O10 - Comments: Nevskii, N.N.; Ivanova, L.I.; Belov, N.V.; Ilyukhin, V.V. Crystal structure of calcium-germanium chondrodite Ca5 (Ge O4)2 (O H)2 Doklady Akademii Nauk SSSR 243 (1978) 345-347 Space group: P 1 1 21/b Cell volume: 512.073 Cell parameters: 8.9345; 11.592; 5.2186; 90; 90; 108.66;

COD ID: 1530496
CIF file	Formula: - Ge Na2 O5 Zr - Comments: Nosirev, N.A.; Treushnikov, E.N.; Ilyukhin, V.V.; Belov, V.V. About the crystal structure of Na, Zr-oxyortho-Germanate Na2 Zr Ge O5 Doklady Akademii Nauk SSSR 216 (1974) 82-85 Space group: P 1 1 21/b Cell volume: 942.354 Cell parameters: 14.1; 13.88; 5.56; 90; 90; 120;

COD ID: 1530498
CIF file	Formula: - D3.56 H4.44 Na2 O12 S2 Zn - Comments: Nozik, Yu.Z.; Fykin, L.E. The position of hydrogen atoms and isotopic effects in the hydrogen bonds in Zn-astrakhanite European Crystallographic Meeting 6 (1980) 109-109 Space group: P 1 1 21/b Cell volume: 495.352 Cell parameters: 5.531; 11.041; 8.241; 90; 90; 100.17;

COD ID: 1530522
CIF file	Formula: - F4 Sb Tl - Comments: Ovchinnikov, V.E.; Udovenko, A.A.; Solov'eva, L.P.; Davidovich, R.L.; Volkova, L.M. Crystal structures of thallium and ammonium tetrafluoroantimonies(III) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 8 (1982) 697-701 Space group: P 1 1 21/b Cell volume: 432.976 Cell parameters: 7.441; 8.343; 7.061; 90; 90; 98.98;

COD ID: 1530523
CIF file	Formula: - F4 H4 N Sb - Comments: Ovchinnikov, V.E.; Udovenko, A.A.; Solov'eva, L.P.; Volkova, L.M.; Davidovich, R.L. Crystal sturctures of thallium and ammonium tetrafluoroantimonies(III) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 8 (1982) 697-701 Space group: P 1 1 21/b Cell volume: 903.825 Cell parameters: 8.184; 16.407; 6.947; 90; 90; 104.32;

COD ID: 1530617
CIF file	Formula: - H2 Ho O9 Rb S2 - Comments: Prokof'ev, M.V. Crystal structure of the double sulfate of rubidium and holmium Kristallografiya 26 (1981) 598-600 Space group: P 1 1 21/b Cell volume: 768.449 Cell parameters: 10.361; 17.775; 8.32; 90; 90; 149.9;

COD ID: 1530665
CIF file	Formula: - C3 H15 Cl3 N9 Rh S3 - Comments: Rusanovsky, M.E.; Belov, N.V.; Kiseleva, I.N.; Samus, I.D. The crystal structure of rhodium trithiosemicarbazide chloride (III) (Rh (Thios3) Cl3 Doklady Akademii Nauk SSSR 250 (1980) 361-364 Space group: P 1 1 21/b Cell volume: 1602.42 Cell parameters: 15.396; 9.193; 11.496; 90; 90; 99.99;

COD ID: 1530666
CIF file	Formula: - C3 H23 Cl3 Co N9 O4 S3 - Comments: Rusanovsky, M.E.; Belov, N.V.; Samus, I.D.; Samus, N.M.; Bologa, O.A. The crystal structure of geometrically isomeric forms of trithiosemicarbazidecobalt (III) chlorides Doklady Akademii Nauk SSSR 260 (1981) 98-102 Space group: P 1 1 21/b Cell volume: 2093.53 Cell parameters: 13.507; 9.901; 16.131; 90; 90; 103.96;

COD ID: 1530781
CIF file	Formula: - Li O8 Pr S2 - Comments: Sirotinkin, S.P.; Efremov, V.A.; Pokrovskii, A.N.; Kovba, L.M. Crystal structure of lithium praseodymium sulfate Li Pr (S O4)2 Kristallografiya 23 (1978) 406-408 Space group: P 1 1 21/b Cell volume: 619.155 Cell parameters: 13.69; 7.005; 6.692; 90; 90; 105.25;

COD ID: 1530801
CIF file	Formula: - Cr3 K2 O10 - Comments: Soldatov, E.A.; Bochkova, R.I.; Belov, N.V.; Grishin, I.A.; Kuz'min, E.A. The crystal strucutre of potassium trichromate K2 Cr3 O10 Doklady Akademii Nauk SSSR 239 (1978) 1343-1345 Space group: P 1 1 21/b Cell volume: 950.305 Cell parameters: 7.334; 9.613; 17.32; 90; 90; 128.9;

COD ID: 1530804
CIF file	Formula: - H12 In N O12 Se2 - Comments: Soldatov, E.A.; Ilyukhin, V.V.; Kuz'min, E.A. Crystal structure of N H4 In (Se O4)2 (H2 O)4 Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 20 (1979) 1081-1085 Space group: P 1 1 21/b Cell volume: 1099.15 Cell parameters: 10.728; 9.434; 11.086; 90; 90; 101.58;

COD ID: 1530809
CIF file	Formula: - H8 I2 Mg O10 - Comments: Sorokina, N.I.; Vinogradov, E.E.; Ilyukhin, V.V.; Belov, N.V. Crystal structure of Mg (I O3)2 (H2 O)4 Doklady Akademii Nauk SSSR 247 (1979) 106-109 Space group: P 1 1 21/b Cell volume: 461.757 Cell parameters: 8.321; 8.501; 6.636; 90; 90; 100.36;

COD ID: 1530899

CIF file

Formula: - H I2 K O6 -
Comments: Treushnikov, E.N.; Loshmanov, A.A.; Kalinin, V.R.; Fukin, L.E.; Yamzin, I.I.; Ilyukhin, V.V.; Dudarev, V.Ya.; Solov'ev, S.P. Neutron-diffraction study of the crystal structure of potassium acid iodate alpha-K I O3 H I O3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 5 (1979) 263-267
Space group: P 1 1 21/b
Cell volume: 654.837
Cell parameters: 10.583; 8.626; 7.747; 90; 90; 112.19;

COD ID: 1530920
CIF file	Formula: - Cl3 F2 H8 N2 Sb - Comments: Udovenko, A.A.; Volkova, L.M.; Davidovich, R.L. Crystal structure of (N H4)2 Sb Cl3 F2 and Rb2 Sb Cl3 F2 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 4 (1978) 305-310 Space group: P 1 1 21/b Cell volume: 1686.41 Cell parameters: 15.58; 17.37; 7.46; 90; 90; 123.35;

COD ID: 1534307
CIF file	Formula: - K6 Mn2 O6 - Comments: Brachtel, G.; Hoppe, R. K6 Mn2 O6 und K6 F E O6 - ein Vergleich Zeitschrift fuer Anorganische und Allgemeine Chemie 446 (1978) 64-76 Space group: P 1 1 21/b Cell volume: 507.59 Cell parameters: 8.886; 6.76; 11.394; 90; 90; 132.13;

COD ID: 1534431
CIF file	Formula: - Cl7 Fe S - Comments: Rybakov, V.B.; Timoshchenko, N.I.; Volkov, S.V.; Aslanov, L.A.; Fokina, Z.A. X-ray investigation of iron(III) halogenchalcogenide complexes Zhurnal Neorganicheskoi Khimii 36 (1991) 2541-2548 Space group: P 1 1 21/b Cell volume: 1036.66 Cell parameters: 6.417; 13.356; 12.359; 90; 90; 101.85;

COD ID: 1534447

CIF file

Formula: - Cl14 Rh2 Se4 -
Comments: Rybakov, V.B.; Grafov, A.V.; Aslanov, L.A.; Volkov, S.V.; Fokina, Z.A.; Pekhn'o, V.I. Crystal and molecular structures of binuclear complex of rhodium(III) chloride with selenium dichloride and complex of iridium(III) chloride with sulfur dichloride and trichloride Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 33 (1992) 146-148
Space group: P 1 1 21/b
Cell volume: 1081.8
Cell parameters: 7.883; 10.672; 12.928; 90; 90; 95.92;

COD ID: 1535487
CIF file	Formula: - F5 H4 N Zr - Comments: Tkachev, V.V.; Davidovich, R.L.; Atovmyan, L.O. Crystal structure of waterless ammonium pentafluorozirconate Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 17 (1991) 1483-1484 Space group: P 1 1 21/b Cell volume: 425.275 Cell parameters: 7.973; 7.923; 7.911; 90; 90; 121.68;

COD ID: 1535662
CIF file	Formula: - Cu F6 H8 O4 Si - Comments: Troyanov, S.I.; Morozov, I.V.; Korenev, Yu.M. Refinement of the crystal structure and the study of thermal stability of CuSiF6(H2O)4. Zhurnal Neorganicheskoi Khimii 37 (1992) 380-387 Space group: P 1 1 21/b Cell volume: 358.248 Cell parameters: 5.346; 7.221; 9.618; 90; 90; 105.23;

COD ID: 1535668
CIF file	Formula: - F12 H12 K2 O6 Zn Zr2 - Comments: Bukvetskii, B.V.; Gerasimenko, A.V.; Davidovich, R.L.; Teplukhina, L.V.; Kaidalova, T.A. Crystal structure of potassium zinc hexafluorozirconate hexahydrate Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 19 (1993) 526-528 Space group: P 1 1 21/b Cell volume: 784.161 Cell parameters: 6.631; 12.952; 10.071; 90; 90; 114.96;

COD ID: 1535672
CIF file	Formula: - F8 H4 K2 Na2 O6 Ti2 - Comments: Bukvetskii, B.V.; Chernyshev, B.N; Bakeeva, N.G.; Didenko, N.A. Crystal structure of the (K, Na)2 Ti2 F8 (O2)2 H2 O peroxoflourotitanate salt Zhurnal Neorganicheskoi Khimii 40 (1995) 1085-1088 Space group: P 1 1 21/b Cell volume: 570.254 Cell parameters: 10.072; 10.415; 5.611; 90; 90; 104.34;

COD ID: 1535777
CIF file	Formula: - H4 K2 O4 Pd - Comments: Il'inets, A.M.; Ivanov-Emin, B.N.; Petrishcheva, L.P.; Izmailovich, A.S. Structure of dipotassium tetrahydroxopalladate(II) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 13 (1987) 1660-1661 Space group: P 1 1 21/b Cell volume: 255.437 Cell parameters: 5.561; 6.947; 6.763; 90; 90; 102.13;

COD ID: 1535829
CIF file	Formula: - Bi Cl3 K N O3 - Comments: Udovenko, A.A.; Davidovich, R.L. Crystal structure of potassium nitratotrichlorobismuthate(III) KBiCl3NO3 Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 17 (1991) 1354-1356 Space group: P 1 1 21/b Cell volume: 736.855 Cell parameters: 9.203; 9.493; 8.685; 90; 90; 103.8;

COD ID: 1535847
CIF file	Formula: - F5 K2 Sb - Comments: Udovenko, A.A.; Eiberman, M.F.; Davidovich, R.L. X-ray investigation of sequential phase transitions in potassium pentafluoroantimonate(III) over a temperature range 323-98 K. II.Crystal structure. Kristallografiya 37 (1992) 735-752 Space group: P 1 1 21/b Cell volume: 1642.2 Cell parameters: 17.012; 14.895; 6.483; 90; 90; 91.48;

COD ID: 1536271
CIF file	Formula: - F H2 O5 Sb Se - Comments: Davidovich, R.L.; Zemnukhova, L.A.; Fedorishcheva, G.A.; Udovenko, A.A.; Eiberman, M.F. Synthesis and investigation of thio- and selenofluoride of antimony(III) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 16 (1990) 926-929 Space group: P 1 1 21/b Cell volume: 502.429 Cell parameters: 8.278; 8.699; 6.99; 90; 90; 93.47;

COD ID: 1536274
CIF file	Formula: - Cs F3 H2 O4 P Sb - Comments: Davidovich, R.L.; Fedorishcheva, G.A.; Zemnukhova, L.A.; Ivanov, S.B.; Kaidalova, T.A. Phosphate-fluoride complex compounds of antimony(III) Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 16 (1990) 177-184 Space group: P 1 1 21/b Cell volume: 711.935 Cell parameters: 10.577; 9.406; 7.356; 90; 90; 103.39;

COD ID: 1540146
CIF file	Formula: - Ge H14 Na2 O10 - Comments: Il'inets, A.M.; Regel', L.L.; Kostrikin, A.V.; Ivanov-Emin, B.N.; Baturin, N.A.; Safronov, L.N. Crystal structure of Na2 (Ge O2 (O H)2) 6(H2 O) Kristallografiya 34 (1989) 1127-1130 Space group: P 1 1 21/b Cell volume: 947.74 Cell parameters: 6.454; 8.405; 17.481; 90; 90; 88.08;

COD ID: 1540984
CIF file	Formula: - B2 Ba H10 O9 - Comments: Simonov, M.A.; Karpov, O.G.; Shvirkst, Ya.Ya.; Gode, G.K. Location of hydrogen atoms in the crystal structure of Ba(B(OH)4)2H2O Kristallografiya 34 (1989) 1292-1294 Space group: P 1 1 21/b Cell volume: 754.242 Cell parameters*: 5.961; 15.16; 8.543; 90; 90; 102.32;

COD ID: 1541788
CIF file	Formula: - H8 La O16 Re3 - Comments: Mashonkin, V.P.; Varfolomeev, M.B.; Ilyukhin, V.V. Crystal Structure of Monoclinic Rare Earth Perrhenate Tetrahydrate Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)) 3 (1977) 1248-1253 Space group: P 1 1 21/b Cell volume: 1439.72 Cell parameters: 11.861; 16.125; 7.546; 90; 90; 94;

COD ID: 1561914
CIF file	Formula: - Ce8 Cl28 Cs4 - Comments: Zhuravleva, M.; Lindsey, A.; Chakoumakos, B.C.; Custelcean, R.; Meilleur, F.; Hughes, R.W.; Kriven, W.M.; Melcher, C.L. Crystal structure and thermal expansion of a CsCe2Cl7 scintillator Journal of Solid State Chemistry 227 (2015) 142-149 Space group: P 1 1 21/b Cell volume: 4818.6 Cell parameters: 19.352; 19.352; 14.838; 90; 90; 119.87;

COD ID: 1570206

CIF file

Formula: - C21 H23 Cu N O9 -
Comments: Ortín-Rubio, Borja; Rostoll-Berenguer, Jaume; Vila, Carlos; Proserpio, Davide M.; Guillerm, Vincent; Juanhuix, Judith; Imaz, Inhar; Maspoch, Daniel Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical science 14(45) (2023) 12984-12994
Space group: P 1 1 21/b
Cell volume: 2085.1
Cell parameters: 11.306; 13.0779; 14.8702; 90; 90; 108.499;

COD ID: 2000503
CIF file Original IUCr paper	Formula: - C14 H13 N S - Comments: Metin, J.; Roche, D.; Veschambre, H.; Madesclaire, M. (<i>E</i>)-Methyl 2-phenyl-2-(3-pyridyl)vinyl sulfide Acta Crystallographica Section C 48(11) (1992) 2098-2100 Space group: P 1 1 21/b Cell volume: 1199.6 Cell parameters: 12.326; 17.177; 5.906; 90; 90; 106.4;

COD ID: 2003007
CIF file Original IUCr paper	Formula: - D2 O4 P Tl - Comments: Ríos, Susana; Paulus, Werner; Cousson, Alain; Quilichini, Marguerite; Heger, Gernot Isotope Effect in TlH~2~PO~4~ and TlD~2~PO~4~ Acta Crystallographica Section B 54(6) (1998) 790-797 Space group: P 1 1 21/b Cell volume: 855.8 Cell parameters: 9.07; 15; 6.575; 90; 90; 106.92;

COD ID: 2004872
CIF file Original IUCr paper	Formula: - C7 H12 As N O5 - Comments: Abdellahi, M. O.; Jouini, T. <i>m</i>-Anisidinium Dihydrogenmonoarsenate Acta Crystallographica Section C 52(5) (1996) 1198-1200 Space group: P 1 1 21/b Cell volume: 1060.6 Cell parameters: 15.32; 7.915; 8.763; 90; 90; 93.5;

COD ID: 2010067

CIF file

Original IUCr paper

Formula: - C10 H24 Cl4 N4 Pt S2 -
Comments: Nguyen-Huy Dung; Viossat, B.; Lancelot, J.C. Sels de S,S'-(alcane-α,ω-diyle)bis(thiouronium). II. Tétrachloroplatinate(II) de S,S'-(octane-1,8-diyle)bis(thiouronium) Acta Crystallographica Section C 50(9) (1994) 1434-1437
Space group: P 1 1 21/b
Cell volume: 984.3
Cell parameters: 7.144; 9.417; 14.862; 90; 90; 100.12;

COD ID: 2013128

CIF file

HKL data

Original IUCr paper

Formula: - Ca4 Na Nb5 O17 -
Comments: Zúñiga, F. J.; Darriet, J. NaCa~4~Nb~5~O~17~: a layered perovskite A~n~B~n~O~3n~+2 compound Acta Crystallographica Section C 59(2) (2003) i18-i20
Space group: P 1 1 21/b
Cell volume: 1358.1
Cell parameters: 7.71; 32.35; 5.4838; 90; 90; 96.82;

COD ID: 2105370
CIF file	Formula: - Ag4 P2 S6 - Comments: Michelet, A.; Toffoli, P.; Khodadad, P.; Rodier, N. Structure de l'Hexathiodiphosphate(IV) d'Argent Acta Crystallographica B (24,1968-38,1982) 38 (1982) 706-710 Space group: P 1 1 21/b Cell volume: 1506.31 Cell parameters: 6.522; 19.616; 11.797; 90; 90; 93.58;

COD ID: 2107010
CIF file	Formula: - Ga La S3 - Comments: Julien-Pouzol, M.; Jaulmes, S.; Dagron, C. Structure du Trisulfure de Lanthane et de Gallium Acta Crystallographica B (24,1968-38,1982) 38 (1982) 1566-1568 Space group: P 1 1 21/b Cell volume: 1381.63 Cell parameters: 10.33; 12.82; 10.56; 90; 90; 98.9;

COD ID: 2107153
CIF file	Formula: - Br Nd S - Comments: Savigny, N.; Adolphe, C.; Zalkin, A.; Templeton, D.H. Structure de Nd S Br et des sulfobromures de terres rares isotypes Acta Crystallographica B (24,1968-38,1982) 29 (1973) 1532-1535 Space group: P 1 1 21/b Cell volume: 333.661 Cell parameters: 6.94; 6.91; 7.05; 90; 90; 99.28;

COD ID: 2107367
CIF file	Formula: - Ca5 Cl O12 P3 - Comments: Mackie, P.E.; Elliott, J.C.; Young, R.A. Monocline structure of synthetic Ca5 (P O4)3 Cl, chlorapatite Acta Crystallographica B (24,1968-38,1982) 28 (1972) 1840-1848 Space group: P 1 1 21/b Cell volume: 1086.02 Cell parameters: 9.628; 19.256; 6.764; 90; 90; 120;

COD ID: 2107427
CIF file	Formula: - As2 H Na O6 - Comments: Nguyen, H.D.; Tahar, J. Hydrogenoarsenate de Sodium Na H As2 O6: Un Nouveau Type d'Anion Bidimensionnel Infini (As2 O6)n(2n-) Acta Crystallographica B (24,1968-38,1982) 34 (1978) 3727-3729 Space group: P 1 1 21/b Cell volume: 478.851 Cell parameters: 5.829; 8.989; 9.154; 90; 90; 93.29;

COD ID: 2107480

CIF file

Original IUCr paper

Formula: - C23 H41 Fe N3 O2 P2 -
Comments: Bichler, Bernhard; Holzhacker, Christian; Glatz, Mathias; Stöger, Berthold; Kirchner, Karl Twinning of three Fe-PNP pincer complexes interpreted according to order‒disorder (OD) theory Acta Crystallographica Section B 71(5) (2015) 524-534
Space group: P 1 1 21/b
Cell volume: 10454
Cell parameters: 31.781; 18.012; 18.262; 90; 90; 90.004;

COD ID: 2109021
CIF file HKL data	Formula: - As4 Cl1.33 O16 Pb6.67 - Comments: Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B 78(4) (2022) Space group: P 1 1 21/b Cell volume: 1349.96 Cell parameters: 10.2378; 20.4573; 7.4457; 90; 90; 120.039;

COD ID: 2109022
CIF file HKL data	Formula: - As3 Cl O12 Pb5 - Comments: Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B 78(4) (2022) Space group: P 1 1 21/b Cell volume: 1354.1 Cell parameters: 10.2398; 20.4774; 7.4554; 90; 90; 119.981;

COD ID: 2109023
CIF file HKL data	Formula: - As2 Cl0.67 O8 Pb3.33 - Comments: Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B 78(4) (2022) Space group: P 1 1 21/b Cell volume: 1357.29 Cell parameters: 10.2552; 20.4913; 7.4576; 90; 90; 119.993;

COD ID: 2109024
CIF file HKL data	Formula: - As4 Cl1.33 O16 Pb6.67 - Comments: Cametti, Georgia; Nagashima, Mariko; Churakov, Sergey V. Role of lone-pair electron localization in temperature-induced phase transitions in mimetite Acta Crystallographica Section B 78(4) (2022) Space group: P 1 1 21/b Cell volume: 1358.26 Cell parameters: 10.2544; 20.5052; 7.4568; 90; 90; 119.971;

COD ID: 2310247
CIF file	Formula: - Ni Y - Comments: Smith, J.F.; Hansen, D.A. The structure of Y Ni Acta Crystallographica (1,1948-23,1967) 18 (1965) 60-62 Space group: P 1 1 21/b Cell volume: 161.586 Cell parameters: 4.114; 7.14; 5.501; 90; 90; 90.05;

COD ID: 4003208

CIF file

Formula: - C5 N5 O -
Comments: Hirsch, Anna; Gur, Dvir; Polishchuk, Iryna; Levy, Davide; Pokroy, Boaz; Cruz-Cabeza, Aurora J.; Addadi, Lia; Kronik, Leeor; Leiserowitz, Leslie “Guanigma”: The Revised Structure of Biogenic Anhydrous Guanine Chemistry of Materials 27(24) (2015) 8289
Space group: P 1 1 21/b
Cell volume: 579.231
Cell parameters: 3.629473; 9.812765; 18.426905; 90; 90; 118.042;

COD ID: 4123978
CIF file	Formula: - Cl4 H9 I O4 - Comments: Bateman, R.J.; Bateman, L.R. Solid-state structure, nuclear quadrupole resonance spectrum, and the resultant symmetry implications for tetrachloro- iodic acid tetrahydrate Journal of the American Chemical Society 94 (1972) 1130-1134 Space group: P 1 1 21/b Cell volume: 506.538 Cell parameters: 8.46; 11.34; 5.31; 90; 90; 96.1;

COD ID: 4308183
CIF file	Formula: - C8.44 H8.89 B0.44 F1.33 Mn0.22 N2.67 O1.33 S0.44 - Comments: Adam P. Forshaw; Ranko P. Bontchev; Jeremy M. Smith Oxidation of the Tris(carbene)borate Complex PhB(MeIm)3MnI(CO)3 to MnIV[PhB(MeIm)3]2(OTf)2 Inorganic Chemistry 46 (2007) 3792-3794 Space group: P 1 1 21/b Cell volume: 2196.38 Cell parameters: 12.8947; 13.5128; 13.9914; 90; 90; 64.28;

COD ID: 4323889
CIF file	Formula: - C28 H53 B9 Mo N2 O3 S2 - Comments: Jae-Hak Kim; Eunkee Hong; Jinkwon Kim; Youngkyu Do Oxidation of Tricarbonylmolybdacarborane. 1. First Examples of Oxomolybda(VI)carboranes Inorganic Chemistry 35 (1996) 5112-5113 Space group: P 1 1 21/b Cell volume: 3835 Cell parameters: 10.307; 19.069; 19.608; 90; 90; 95.67;

COD ID: 7217892

CIF file

Formula: - Ca5 H O13 P3 -
Comments: Espanol, Montserrat; Portillo, Joaquim; Manero, Jose-Maria; Ginebra, Maria-Pau Investigation of the hydroxyapatite obtained as hydrolysis product of α-tricalcium phosphate by transmission electron microscopy CrystEngComm 12(10) (2010) 3318-3326
Space group: P 1 1 21/b
Cell volume: 1060.4
Cell parameters: 9.426; 18.856; 6.887; 90; 90; 119.97;

COD ID: 9001263
CIF file	Formula: - Ca5 Cl0.47 F0.29 H O12.24 P3 - Comments: Hughes J M; Cameron M; Crowley K D Crystal structures of natural ternary apatites: Solid solution in the Ca5(PO4)3X (X = F,OH,Cl) system American Mineralogist 75 (1990) 295-304 Space group: P 1 1 21/b Cell volume: 1063.27 Cell parameters: 9.4877; 18.9628; 6.8224; 90; 90; 119.974;

COD ID: 9002434
CIF file	Formula: - Ca4.899 Cl La0.052 Na0.05 O12 P3 - Comments: Fleet M E; Liu X; Pan Y Rare-earth elements in chlorapatite [Ca10(PO4)6(Cl)2]: Uptake, site preference, and degradation of monoclinic structure Sample: La-ClAp American Mineralogist 85 (2000) 1437-1446 Space group: P 1 1 21/b Cell volume: 1092.36 Cell parameters: 9.6501; 19.3002; 6.7724; 90; 90; 120;

COD ID: 9004240
CIF file	Formula: - As3 Cl O12 Pb5 - Comments: Yongshan, D.; Hughes, J. M.; Moore, P. B. The crystal structures of mimetite and clinomimetite, Pb5(AsO4)3Cl Locality: Johanngeorgenstat, Erzgebirge, Sachsen, Germany The Canadian Mineralogist 29 (1991) 369-376 Space group: P 1 1 21/b Cell volume: 1341.99 Cell parameters: 10.1891; 20.3723; 7.4564; 90; 90; 119.883;

COD ID: 9011105
CIF file	Formula: - Er2 O7 Si2 - Comments: Smolin, Y. I.; Shepelev, Y. F. The crystal structures of the rare earth pyrosilicates Acta Crystallographica, Section B 26 (1970) 484-492 Space group: P 1 1 21/b Cell volume: 279.204 Cell parameters: 4.683; 5.556; 10.79; 90; 90; 96;

COD ID: 9011870
CIF file	Formula: - B3 Ca2 Cl H4 O8 - Comments: Yamnova, N. A.; Simonov, M. A.; Belov, N. V. Refined crystal structure of solongoite Ca2[B3O4(OH)4]Cl Soviet Physics Crystallography 22 (1977) 356-357 Space group: P 1 1 21/b Cell volume: 723.89 Cell parameters: 7.975; 12.571; 7.237; 90; 90; 86.14;

COD ID: 9011876
CIF file	Formula: - Ca5 H2 O10 Si2 - Comments: Kuznetsova, T. P.; Nevskii, N. N.; Ilyukhin, V. V.; Belov, N. V. Refinement of the crystal structure of calcium chondrodite Ca5[SiO4]2(OH)2=Ca(OH)22Ca2SiO4 Locality: synthetic Soviet Physics Crystallography 25 (1980) 91-92 Space group: P 1 1 21/b Cell volume: 492.103 Cell parameters*: 8.9207; 11.4481; 5.0759; 90; 90; 108.32;

COD ID: 9011890
CIF file	Formula: - K2 O7 Si2 Zr - Comments: Chernov, A. N.; Maksimov, B. A.; Ilyukhin, V. V.; Belov, N. V. Crystalline structure of monoclinic modification of K,Zr-diorthosilicate (K2ZrSi2O7) Soviet Physics Doklady 15 (1971) 711-713 Space group: P 1 1 21/b Cell volume: 681.684 Cell parameters: 9.54; 14.26; 5.6; 90; 90; 116.517;

COD ID: 9011894
CIF file	Formula: - B2 Ca Mg O5 - Comments: Yakubovich, O. V.; Yamnova, N. A.; Shchedrin, B. M.; Simonov, M. A.; Belov, N. V. Crystal structure of magnesium kurchatovite CaMg[B2O5] Soviet Physics Doklady 21 (1976) 294-295 Space group: P 1 1 21/b Cell volume: 735.479 Cell parameters: 12.331; 5.489; 11.092; 90; 90; 78.42;

COD ID: 9011900
CIF file	Formula: - B2 Ca Fe0.11 Mg0.89 O5 - Comments: Simonov, M. A.; Egorov-Tismenko Y K; Yamnova, M. A.; Belokoneva, E. L.; Belov, N. V. Crystal structure of natural monoclinic kurchatovite Ca2(Mg0.86Fe0.14)(Mg0.92Fe0.08)[B2O5]2 Soviet Physics Doklady 25 (1980) 1125-1128 Space group: P 1 1 21/b Cell volume: 741.948 Cell parameters: 12.45; 5.514; 11.145; 90; 90; 104.13;

COD ID: 9011901

CIF file

Formula: - H2 K2 O10 Si3 Zr -
Comments: Ilyukhin, V. V.; Khomyakov, A. P.; Shumyatskaya, N. G.; Voronkov, A. A.; Nevskii, N. N.; Belov, N. V. The crystal structure of the new natural zirconosilicate K4Zr2Si6O18*2H2O Note: dimorphic with umbite Note: y(O7) corrected Soviet Physics Doklady 26 (1981) 118-120
Space group: P 1 1 21/b
Cell volume: 978.253
Cell parameters: 6.565; 13.171; 11.727; 90; 90; 105.26;

COD ID: 9012621
CIF file	Formula: - B9 Ca2 H8 Na O20 - Comments: Yamnova, N. A.; Egorov-Tismenko Yu K; Pushcharovskii D Yu; Malinko, S. V.; Dorokhova, G. I. Crystal structure of a new natural Na,Ca-hydroborate NaCa2[B9O14(OH)4]2H2O Crystallography Reports 38 (1993) 749-752 Space group: P 1 1 21/b Cell volume: 1502.96 Cell parameters*: 11.503; 10.53; 12.58; 90; 90; 99.48;

COD ID: 9012751
CIF file	Formula: - Ca H12 O17 Si2 U2 - Comments: Barinova, A. V.; Rastsvetaeva, R. K.; Sidorenko, G. A.; Pushcharovsky, D. Y. Crystal structure of high-symmetry alpha-uranophane Doklady Chemistry 378 (2001) 122-124 Space group: P 1 1 21/b Cell volume: 735.7 Cell parameters: 6.67; 15.92; 6.985; 90; 90; 97.3;

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