# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T12:46:45+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'B 1 1 2/m' AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1521922","23.063","","10.689","","2.944","","90","","90","","76.4","","705.407","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","Na5.42 (Mg0.7 Ti7.3) O18","","- Mg0.7 Na5.42 O18 Ti7.3 -","- Mg0.7 Na5.42 O18 Ti7.3 -","- Mg1.4 Na10.84 O36 Ti14.6 -","2","0.25","","Shilov, G.V.; Atovmyan, L.O.; Volochaev, V.A.; Nalbadyan, V.B.","Crystal structure and ionic conductivity of a new sodium magnesium titanium oxide","Kristallografiya","1999","44","","1029","1033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1523729","20.802","","15.346","","4.0736","","90","","90","","125.8","","1054.71","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","","","- Ga21 Ho4 Ni10 -","- Ga21 Ho4 Ni10 -","- Ga42 Ho8 Ni20 -","2","0.25","","Grin', Yu.; Yarmolyuk, Ya.P.; Gladyshevskii, E.I.","The crystal structure of Ga21 Ho4 Ni10","Doklady Akademii Nauk SSSR","1979","245","","1102","1106","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1526100","24.787","","13.126","","11.318","","90","","90","","122.36","","3110.5","","","","","","","","","","","","","5","B 1 1 2/m","-B 2","12","","Rb11 (Cu2 (H2 O)2) (Cu15 Cl24 (Cu Cl6))","","- Cl30 Cu18 H4 O2 Rb11 -","- Cl30 Cu18 O2 Rb11 -","- Cl60 Cu36 O4 Rb22 -","2","0.25","","Mykhalichko, B.M.; Gelzak-Kotsvin, K.; Mys'kiv, M.G.","Guest-host copper(I,II) complex (Rb11 (Cu(I)2 (H2 O)2)) (Cu(I)15 Cl24 (Cu(II) Cl6)). Effect of the nature of the (Cu(I)2 (H2 O)2)(2+) guest on crystal structure formation","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2000","41","","559","566","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526485","12.365","","7.482","","5.638","","90","","90","","107.73","","496.824","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Ho5 Re2 O12","","- Ho5 O12 Re2 -","- Ho5 O12 Re2 -","- Ho10 O24 Re4 -","2","0.25","","Jeitschko, W.; Heumannskaemper, D.H.; Schriewer-Poettgen, M.S.; Rodewald, U.C.","Preparation and crystal structure of rare earth rhenates: the series Ln5 Re2 O12 with Ln = Y, Gd-Lu, and the praseodymium rhenates Pr3 Re O8, Pr3 Re2 O10 and Pr4 Re2 O11","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","80","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1527405","15.91","","8.399","","7.642","","90","","90","","121.09","","874.5","","","","","","","","","","","","","5","B 1 1 2/m","-B 2","12","","(N H4)3 (N (Ru Cl4 (H2 O))2)","","- Cl8 H16 N4 O2 Ru2 -","- Cl8 H16 N4 O2 Ru2 -","- Cl16 H32 N8 O4 Ru4 -","2","0.25","","Gee, R.J.D.; Powell, H.M.","The crystal and molecular structure of ammonium mue-nitrido-bis(aquotetrachlororuthenate(IV))","Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971)","1971","1971","","1795","1797","","","","","","","","","","","","","","","","","","","","","","has coordinates","186594","2020-10-21","18:00:00",""
"1530005","10.697","","10.561","","6.176","","90","","90","","109.73","","656.749","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","Na Cs2 (Al F6)","","- Al Cs2 F6 Na -","- Al Cs2 F6 Na -","- Al4 Cs8 F24 Na4 -","4","0.5","","Golovastikov, N.I.; Belov, N.V.","The crystal structure of sodium cesium fluoroaluminate Cs2 Na Al F6","Kristallografiya","1978","23","","42","46","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530521","15.715","","8.896","","7.514","","90","","90","","56.506","","876.026","","","","","","","","","","","","","5","B 1 1 2/m","-B 2","12","","Mn (Zr F6) (H2 O)5","","- F6 H10 Mn O5 Zr -","- F6 Mn O5 Zr -","- F24 Mn4 O20 Zr4 -","4","0.5","","Otroshchenko, L.P.; Davidovich, R.L.; Simonov, V.I.","Crystal structure of manganese hexafluorozirconate pentahydrate","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1978","4","","1416","1419","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530922","15.02","","7.17","","5.69","","90","","90","","92.3","","612.282","","","","","","","","","","","","","5","B 1 1 2/m","-B 2","12","","K3 (Sb2 F7 (N O3)2)","","- F7 K3 N2 O6 Sb2 -","- F7 K3 N2 O6 Sb2 -","- F14 K6 N4 O12 Sb4 -","2","0.25","","Udovenko, A.A.; Volkova, L.M.; Davidovich, R.L.; Simonov, M.A.","Crystal structure of di- and trinitraroheptafluorodiantimonates(III) of potassium K (Sb2 F7) (K N O3)2 and K (Sb2 F7) (K N O3)3","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1979","5","","133","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1530944","6.59","","4.91","","8.72","","90","","90","","102","","275.986","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","In2 Ge2 O7","","- Ge2 In2 O7 -","- Ge2 In2 O7 -","- Ge4 In4 O14 -","2","0.25","","Vavilin, V.I.; Ilyukhin, V.V.; Soldatov, E.A.; Kuz'min, E.A.; Gladkih, E.A.; Belov, N.V.","About the crystal structure of indium pyrogermanate In2 Ge2 O7","Doklady Akademii Nauk SSSR","1973","213","","837","839","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1530966","13.39","","10.58","","8.463","","90","","90","","101.6","","1174.43","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Sc U8 S17","","- S17 Sc U8 -","- S17 Sc U8 -","- S34 Sc2 U16 -","2","0.25","","Vovan, T.; Rodier, N.","Sur un nouveau sulfure mixte de scandium et d'uranium de formule Sc U8 S17.","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1979","289","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530999","11.43","","7.89","","3.67","","90","","90","","90.2","","330.968","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","Nd Cr O S2","","- Cr Nd O S2 -","- Cr Nd O S2 -","- Cr4 Nd4 O4 S8 -","4","0.5","","Wintenberger, M.; Dugue, J.; Guittard, M.; Tien, V.; Dung, N.H.","Ferro- and antiferromagnetism in oxychalcogenides Ln Cr O X2 (Ln= La or Nd and X= S or Se)","Journal of Solid State Chemistry","1987","70","","295","302","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532935","10.948","","10.839","","4.302","","90","","90","","123.23","","427.02","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Sm2 Ru Ge2","","- Ge2 Ru Sm2 -","- Ge2 Ru Sm2 -","- Ge8 Ru4 Sm8 -","4","0.5","","Morozkin, A.V.; Seropegin, Yu.D.","Sm - Ru - Ge system at 1070 K","Journal of Alloys Compd.","2004","365","","168","172","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532942","10.899","","8.139","","4.319","","90","","90","","109.29","","361.616","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Sm3 Ru2 Ge4","","- Ge4 Ru2 Sm3 -","- Ge4 Ru2 Sm3 -","- Ge8 Ru4 Sm6 -","2","0.25","","Morozkin, A.V.; Seropegin, Yu.D.","Sm - Ru - Ge system at 1070 K","Journal of Alloys Compd.","2004","365","","168","172","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1533729","8.146","","10.756","","8.359","","90","","90","","100.92","","719.14","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Y2 (Ge3.876 Ga2.924)","","- Ga2.924 Ge3.876 Y2 -","- Ga2.924 Ge3.876 Y2 -","- Ga11.696 Ge15.504 Y8 -","4","0.5","","Speka, M.V.; Zakharenko, M.I.; Markiv, V.Ya.; Belyavina, N.M.","Isothermal section of the Y - Ge - Ga system at 600 C in the region up to 37 at% Y","Journal of Alloys Compd.","2004","368","","41","46","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1534498","22.964","","10.792","","6.777","","90","","90","","112.2","","1555.03","","","","","","","","","","","","","5","B 1 1 2/m","-B 2","12","","Cs6 (Hf4 F20 (H2 O)4) (Hf F6)","","- Cs6 F26 H8 Hf5 O4 -","- Cs6 F26 Hf5 O4 -","- Cs12 F52 Hf10 O8 -","2","0.25","","Gerasimenko, A.V.; Bukvetskii, B.V.; Logvinova, V.B.; Davidovich, R.L.","Crystal structure of double cesium fluorohafnate Cs4(Hf4F20(H2O)4)*Cs2HfF6","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1991","17","","1486","1487","","","","","","","","","","","","","","","","","","","","","","has coordinates","209184","2020-10-21","18:00:00",""
"1534849","37.586","","9.451","","2.969","","90","","90","","86.29","","1052.45","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","Na20 Mg2 Ti20 O52","","- Mg2 Na20 O52 Ti20 -","- Mg2.002 Na20 O52 Ti19.998 -","- Mg2.002 Na20 O52 Ti19.998 -","1","0.125","","Shilov, G.V.; Atovmyan, L.O.","Composition and structure of solid electrolyte: sodium-magnesium-titanium ternary oxide.","Kristallografiya","1995","40","","824","828","","","","","","","","","","","","","","","","","","","","","","has coordinates","209184","2020-10-21","18:00:00",""
"1538155","14.18","","15.48","","13.7","","90","","90","","117","","2679.47","","","","","","","","","","","","","6","B 1 1 2/m","-B 2","12","","Na2.736 K4.61 Ti8.72 (O H)2 (Si16 O56) (H2 O)7.84","","- H17.68 K4.61 Na2.736 O65.84 Si16 Ti8.72 -","- K4.61 Na2.736 O64.836 Si16 Ti8.72 -","- K9.22 Na5.472 O129.672 Si32 Ti17.44 -","2","0.25","","Golovastikov, N.I.","Crystal structure of the alkali titanosilicate labuntsovite","Kristallografiya","1973","18","","950","955","","","","","","","","","","","","","","","","","","","","","","has coordinates","209184","2020-10-21","18:00:00",""
"1541944","14.4","","12.1","","5.64","","90","","90","","111.3","","915.586","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","Er (H2 P O2)3","","- Er H6 O6 P3 -","- Er O6 P3 -","- Er4 O24 P12 -","4","0.5","","Aslanov, L.A.; Ionov, V.M.; Porai-Koshits, M.A.; Gilyarov, O.N.; Lebedev, V.G.; Kulikovskii, B.N.; Novoderezhkina, T.L.","Crystal structure of erbium hypophosphite","Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy","1975","11","","117","119","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106259","21.41","","6.552","","10.68","","90","","90","","122.28","","1266.63","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","Zn4 (P2 S6)3","","- P6 S18 Zn4 -","- P6 S18 Zn4 -","- P12 S36 Zn8 -","2","0.25","","Bouchetiere, M.; Toffoli, P.; Khodadad, P.; Rodier, N.","Structure cristalline de Zn4 (P2 S6)3","Acta Crystallographica B (24,1968-38,1982)","1978","34","","384","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2106301","11.518","","7.951","","3.703","","90","","90","","90.07","","339.119","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","","","- Ce Cr O S2 -","- Ce Cr O S2 -","- Ce4 Cr4 O4 S8 -","4","0.5","","Dugue, J.; Villers, J.; Vovan, T.","Etude Structurale des Oxysulfures de Chrome(III) et de Terres Rares. II. Structure de l'Oxysulfure Ce Cr O S2","Acta Crystallographica B (24,1968-38,1982)","1980","36","","1294","1297","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106325","7.441","","7.448","","3.978","","90","","90","","113.66","","201.932","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","(Mn0.6666 Cr0.3333) I2","","- Cr0.3333 I2 Mn0.6666 -","- Cr0.3333 I2 Mn0.6666 -","- Cr0.6666 I4 Mn1.3332 -","2","0.25","","Guen, L.; Nguyen, H.D.","Manganese(II) chrome(II) diiodure: phase beta des (Mn, Cr) I2","Acta Crystallographica B (24,1968-38,1982)","1976","32","","311","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2106853","29.71","","21.83","","3.941","","90","","90","","122","","2167.62","","","","","","","","","","","","","3","B 1 1 2/m","-B 2","12","","","","- Er9 La10 S27 -","- Er9 La10 S27 -","- Er18 La20 S54 -","2","0.25","","Carre, D.; Laruelle, P.","Structure cristalline du sulfure d'erbium et de lanthanum, Er9 La10 S27","Acta Crystallographica B (24,1968-38,1982)","1973","29","","70","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104358","18.73","","10.3","","7.54","","90","","90","","107.9","","1384.2","","","","","","","","","","","","","7","B 1 1 2/m","-B 2","12","","(Na1.1 K0.7 Ca1.7) (Al5.2 Si18.8 O48) (H2 O)12.7","","- Al5.2 Ca1.7 H25.4 K0.7 Na1.1 O60.7 Si18.8 -","- Al5.28 Ca1.68 K0.72 Na1.12 O60.72 Si18.72 -","- Al5.28 Ca1.68 K0.72 Na1.12 O60.72 Si18.72 -","1","0.125","","Gottardi, G.; Meier, W.M.","The crystal structure of dachiardite","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1963","119","","53","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9011859","14.18","","7.74","","13.7","","90","","90","","117","","1339.73","","","","","","","","","","","","","6","B 1 1 2/m","-B 2","12","","","Labuntsovite-Mn","- H17 K2.305 Na1.37 O32.425 Si8 Ti4.61 -","- H6.8504 K2.305 Na1.37 O32.4252 Si8 Ti4.61 -","- H13.7008 K4.61 Na2.74 O64.8504 Si16 Ti9.22 -","2","0.25","","Golovastikov, N. I.","Crystal structure of the alkali titanosilicate labuntsovite Sample: half-cell","Soviet Physics Crystallography","1974","18","","596","599","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46",""
"9011862","14.18","","15.48","","13.7","","90","","90","","117","","2679.47","","","","","","","","","","","","","7","B 1 1 2/m","-B 2","12","","","Labuntsovite-Mn","- H18 K4.61 Na2.736 Nb0.5 O64.836 Si16 Ti8.22 -","- H15.672 K4.61 Na2.736 Nb0.5 O64.836 Si16 Ti8.22 -","- H31.344 K9.22 Na5.472 Nb O129.672 Si32 Ti16.44 -","2","0.25","","Golovastikov, N. I.","Crystal structure of the alkali titanosilicate labuntsovite Sample: double cell","Soviet Physics Crystallography","1973","18","","950","955","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:11",""
"9014209","19.8392","","5.5108","","6.1009","","90","","90","","104.477","","645.832","","","","","","","","","","","","Synthetic","5","B 1 1 2/m","-B 2","12","","","Deloryite","- Cu4 H6 Mo2 O16 U -","- Cu4 H6 Mo2 O16 U -","- Cu8 H12 Mo4 O32 U2 -","2","0.25","","Tali, R.; Tabachenko, V. V.; Kovba, L. M.","Crystal structure of Cu4UO2(MoO4)2(OH)6","Russian Journal of Inorganic Chemistry","1993","38","","1350","1352","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""