# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-27T14:16:57+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'The Structure of Crystals') AND volume = 4 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
"5910002","7.01","","12.6","","15.6","","90","","108.4","","90","","1307.44","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","antimony pentachloride-tetrasulfotetrimide","","- Cl5 N4 S4 Sb -","- Cl80 N64 S64 Sb16 -","- Cl80 N64 S64 Sb16 -","","","","Wyckoff, R. W. G.","Pages 110 & 111 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","110","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910040","14.53","","14.24","","8.02","","90","","90","","90","","1659.4","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","","","- Cl10 O2 P2 Sn -","- Cl256 O32 P32 Sn16 -","- Cl256 O32 P32 Sn16 -","","","","Wyckoff, R. W. G.","Pages 116 & 117 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","116","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910055","9.193","","9.193","","4.299","","90","","90","","90","","363.314","","","","","","","","","","","","","3","P -4 21 c","P -4 2n","114","","","","- F4 N4 S4 -","- F64 N64 S64 -","- F64 N64 S64 -","","","","Wyckoff, R. W. G.","Page 104 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","104","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910058","5.49","","11.14","","6.05","","90","","98.42","","90","","366.021","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Tri thiazyl chloride","","- Cl3 N3 S3 -","- Cl12 N20 S20 -","- Cl12 N20 S20 -","","","","Wyckoff, R. W. G.","Pages 103 & 104 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951.","The Structure of Crystals","1951","4","","103","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910084","9.24","","9.24","","16.26","","90","","95.34","","90","","1382.21","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Cl8 O2 Se2 Sn -","- Cl256 O64 Se64 Sn16 -","- Cl256 O64 Se64 Sn16 -","","","","Wyckoff, R. W. G.","Pages 118 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","118","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910094","7.97","","12.19","","6.75","","90","","90","","90","","655.792","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- H4 N4 S4 -","- N32 S128 -","- N32 S128 -","","","","Wyckoff, R. W. G.","Page 105 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","105","105","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910162","6.546","","8.6","","5.508","","90","","102.22","","90","","303.05","","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- Cl2 N2 S3 -","- Cl8 N8 S12 -","- Cl8 N8 S12 -","","","","Wyckoff, R. W. G.","Pages 101 & 102 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","101","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910165","8.811","","8.811","","8.811","","90","","90","","90","","684.031","","","","","","","","","","","","","4","P -4 3 m","P -4 2 3","215","","","","- C12 Ni4 O18 P4 -","- Ni16 O276 P16 -","- Ni16 O276 P16 -","","","","Wyckoff, R. W. G.","Pages 91 & 92 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","91","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910179","6.63","","7.85","","11.46","","83.2","","76.9","","78.25","","567.112","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C2 Fe2 O6 S2 -","- C24 Fe8 O24 S8 -","- C24 Fe8 O24 S8 -","","","","Wyckoff, R. W. G.","Pages 35 & 36 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","35","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910183","13.99","","4.12","","17.84","","90","","116","","90","","924.209","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- B3 Br3 S3 -","- B48 Br48 S48 -","- B48 Br48 S48 -","","","","Wyckoff, R. W. G.","Pages 11 & 12 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","11","12","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910188","8.5621","","8.5621","","11.5288","","90","","90","","90","","845.171","","","","","","","","","","","","","5","P 4/m n c","-P 4 2n","128","","","","- Cl2 K5 Na O12 S4 -","- Cl16 K68 Na4 O320 S64 -","- Cl16 K68 Na4 O320 S64 -","","","","Wyckoff, R. W. G.","Pages 48-51 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","48","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910192","3.949","","10.192","","14.721","","90","","90","","90","","592.494","","","","","","","","","","","","","4","A m m 2","A 2 -2","38","","","","- F Na Nb6 O15 -","- Na4 Nb20 O16 -","- Na4 Nb20 O16 -","","","","Wyckoff, R. W. G.","Pages 79 & 80 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","79","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910201","3.226","","3.226","","31.7","","90","","90","","120","","285.706","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- C3 Al7 N3 -","- C10 Al28 N12 -","- C10 Al28 N12 -","","","","Wyckoff, R. W. G.","Pages 9 & 10 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","9","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910205","10.1","","10.1","","10.1","","90","","90","","90","","1030.3","","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","","sulfohalite","","- Cl F Na6 O8 S2 -","- Cl4 F4 Na144 O256 S16 -","- Cl4 F4 Na144 O256 S16 -","","","","Wyckoff, R. W. G.","Page 82 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","82","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910209","11.62","","5.49","","8.44","","90","","97.42","","90","","533.911","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","sodium tridecafluoro dizirconate","","- F13 Na5 Zr2 -","- F196 Na36 Zr16 -","- F196 Na36 Zr16 -","","","","Wyckoff, R. W. G.","Page 84 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","84","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910213","9.57","","5.5","","12.95","","90","","90","","90","","681.623","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","sodium molybdenum bronze","","- Mo6 Na0.9 O17 -","- Mo48 Na4 O200 -","- Mo48 Na4 O200 -","","","","Wyckoff, R. W. G.","Pages 78 &79 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","78","79","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910214","9.613","","9.613","","9.613","","90","","90","","90","","888.335","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Ga Li3 N2 -","- Ga256 Li384 N128 -","- Ga256 Li384 N128 -","","","","Wyckoff, R. W. G.","Pages 57 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","57","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910216","10.706","","8.852","","10.663","","90","","109.45","","90","","952.859","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Cl4 Co5 Mo4 Na2 O16 -","- Cl64 Co68 Mo24 Na16 O192 -","- Cl64 Co68 Mo24 Na16 O192 -","","","","Wyckoff, R. W. G.","Page 75 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","75","75","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910217","3.086","","17.35","","3.047","","90","","90","","90","","163.143","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- C B Mo2 -","- C16 B16 Mo32 -","- C16 B16 Mo32 -","","","","Wyckoff, R. W. G.","Page 64 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","64","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910218","9.48","","9.48","","9.48","","90","","90","","90","","851.971","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","","","- Al Li3 N2 -","- Al128 Li384 N128 -","- Al128 Li384 N128 -","","","","Wyckoff, R. W. G.","Page 57 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","57","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910220","22.4","","3.834","","15.37","","90","","91.47","","90","","1319.57","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Na Nb13 O33 -","- Na4 Nb100 O260 -","- Na4 Nb100 O260 -","","","","Wyckoff, R. W. G.","Pages 80 & 81 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","80","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910227","5.277","","5.277","","9.157","","90","","90","","120","","220.83","","","","","","","","","","","","","4","P 6/m m m","-P 6 2","191","","potassium iodo diarsenite","","- As4 I K O6 -","- As16 I K O36 -","- As16 I K O36 -","","","","Wyckoff, R. W. G.","Pages 40 & 41 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","40","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910229","11.92","","7.71","","5.83","","90","","99.4","","90","","528.601","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Cl4 Cs2 O2 U -","- Cl64 Cs16 O16 U4 -","- Cl64 Cs16 O16 U4 -","","","","Wyckoff, R. W. G.","Page 27 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","27","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910240","9.9","","9.808","","6.39","","90","","103.3","","90","","603.822","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Br4 Cs2 O2 U -","- Br32 Cs16 O16 U4 -","- Br32 Cs16 O16 U4 -","","","","Wyckoff, R. W. G.","Page 27 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","27","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910260","6.667","","6.667","","10.054","","90","","90","","120","","387.017","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","","","- Hg2 I Na O2 -","- Hg36 I12 Na9 O36 -","- Hg36 I12 Na9 O36 -","","","","Wyckoff, R. W. G.","Pages 76 & 77 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","76","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910265","5.29","","5.29","","9.11","","90","","90","","120","","220.78","","","","","","","","","","","","","4","P 6/m m m","-P 6 2","191","","soium iodo diarsenite","","- As4 I Na O6 -","- As16 I Na O36 -","- As16 I Na O36 -","","","","Wyckoff, R. W. G.","Pages 40, 41 & 42 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","40","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910270","9.414","","9.492","","6.227","","90","","100.18","","90","","547.671","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- B H9 N3 P -","- B16 H144 N48 P16 -","- B16 H144 N48 P16 -","","","","Wyckoff, R. W. G.","Pages 68 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","68","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910271","5.26","","5.26","","8.97","","90","","90","","120","","214.929","","","","","","","","","","","","","4","P 6/m m m","-P 6 2","191","","","","- As4 Br K O6 -","- As16 Br K O36 -","- As16 Br K O36 -","","","","Wyckoff, R. W. G.","Pages 40, 41 & 42 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","40","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910281","9.607","","9.607","","5.508","","90","","90","","120","","440.251","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","potassium rhenium hydride","","- H9 K2 Re -","- H225 K18 Re5 -","- H225 K18 Re5 -","","","","Wyckoff, R. W. G.","Pages 51 & 52 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","51","52","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910298","14.023","","14.023","","14.023","","90","","90","","90","","2757.55","","","","","","","","","","","","","3","F -4 3 m","F -4 2 3","216","","","","- Be17 Ca12 O29 -","- Be260 Ca96 O404 -","- Be260 Ca96 O404 -","","","","Wyckoff, R. W. G.","Page 22 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","22","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910313","6.57","","6.57","","18.62","","90","","90","","90","","803.73","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","","","- Be F12 Li6 Zr -","- Be8 F384 Li160 Zr8 -","- Be8 F384 Li160 Zr8 -","","","","Wyckoff, R. W. G.","Pages 57 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","57","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910335","11.58","","10.81","","9.14","","90","","112","","90","","1060.83","","","","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Ba K2 O12 S12 -","- Ba4 K8 O96 S96 -","- Ba4 K8 O96 S96 -","","","","Wyckoff, R. W. G.","Pages 42 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","42","42","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910344","7.552","","11.54","","10.078","","90","","90","","90","","878.299","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","alpha-sulfanuric chloride","","- Cl3 N3 O3 S3 -","- Cl48 N80 O80 S80 -","- Cl48 N80 O80 S80 -","","","","Wyckoff, R. W. G.","Pages 108 & 109 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","108","109","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""