# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-01T08:34:37+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 'Zeitschrift für Kristallographie') AND volume = 196 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
"1008872","13.716","0.006","7.642","0.004","8.527","0.005","90","","90.3","0.1","90","","893.8","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Decasodium di-$-mue-arsenido-bis(diarsenidostannate)","","- As6 Na10 Sn2 -","- As6 Na10 Sn2 -","- As12 Na20 Sn4 -","2","0.5","","Eisenmann, B; Klein, J","Dimere Zintl-Anionen (Sn2 As6)10- und (Sn2 Sb6)10- in Alkaliverbindungen","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","213","229","","","","","","","0.072","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008873","20.435","0.009","6.82","0.003","15.351","0.005","90","","90","","90","","2139.4","","","","","","","","","","","","","4","C m c e","-C 2ac 2","64","","Tetrasodium hexapotassium di-$-mue-arsenido-bis(diarsenidostannate)","","- As6 K6 Na4 Sn2 -","- As6 K6 Na4 Sn2 -","- As24 K24 Na16 Sn8 -","4","0.25","","Eisenmann, B; Klein, J","Dimere Zintl-Anionen (Sn2 As6)10- und (Sn2 Sb6)10- in Alkaliverbindungen","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","213","229","","","","","","","0.072","","","","","","","","","","","","","","","has coordinates","282761","2023-04-20","06:45:55",""
"2002500","9.4085","0.0066","3.9801","0.0019","3.198","0.0008","90","","90","","90","","119.8","","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Cobalt dicopper oxide","","- Co Cu2 O3 -","- Co Cu2 O3 -","- Co2 Cu4 O6 -","2","0.25","","Mueller-Buschbaum, Hk; Tomaszewska, A","Das erste Uebergangsmetall-Oxocuprat(II) mit Ca Cu2 O3-Struktur. Zur Kenntnis von Co Cu2 O3 und Ca(1-x) Co(x) Cu2 O3 (x = 0,55)","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","121","127","","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002501","9.532","0.009","4.015","0.002","3.2841","0.0008","90","","90","","90","","125.7","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","Calcium cobalt copper oxide (0.45/0.55/2/3)","","- Ca0.45 Co0.55 Cu2 O3 -","- Ca0.45 Co0.55 Cu2 O3 -","- Ca0.9 Co1.1 Cu4 O6 -","2","0.25","","Mueller-Buschbaum, Hk; Tomaszewska, A","Das erste Uebergangsmetall-Oxocuprat(II) mit Ca Cu2 O3-Struktur. Zur Kenntnis von Co Cu2 O3 und Ca(1-x) Co(x) Cu2 O3 (x = 0,55)","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","121","127","","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"8103411","7.149","","7.149","","18.063","","90","","90","","90","","923.167","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Ag6 (Ge O4) (S O4)","","- Ag6 Ge O8 S -","- Ag6 Ge O8 S -","- Ag24 Ge4 O32 S4 -","4","0.125","","Jansen, M.; Heidebrecht, K.","Crystal structure of silver(I) germanate sulfate","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","294","295","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103447","5.157","","5.157","","21.433","","90","","90","","120","","493.637","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Ca3 Ni7 B2","","- B2 Ca3 Ni7 -","- B2 Ca3 Ni7 -","- B6 Ca9 Ni21 -","3","0.0833333","","Weltzer, M.; Jung, W.","Die ternaeren Calcium-Nickelboride CaNi4B, Ca3Ni7B2, Ca5Ni15B4 und CaNi12B6","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","169","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103479","5.066","","5.066","","6.844","","90","","90","","120","","152.115","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Ca Ni4 B","","- B Ca Ni4 -","- B Ca Ni4 -","- B2 Ca2 Ni8 -","2","0.0833333","","Jung, W.; Weltzer, M.","Die ternaeren Calcium-Nickelboride CaNi4B, Ca3Ni7B2, Ca5Ni15B4 und CaNi12B6","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","169","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103487","9.528","","9.528","","7.407","","90","","90","","120","","582.34","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Ca Ni12 B6","","- B6 Ca Ni12 -","- B6 Ca Ni12 -","- B18 Ca3 Ni36 -","3","0.0833333","","Jung, W.; Weltzer, M.","Die ternaeren Calcium-Nickelboride CaNi4B, Ca3Ni7B2, Ca5Ni15B4 und CaNi12B6","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","169","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103488","5.115","","5.115","","27.946","","90","","90","","120","","633.201","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ca5 Ni15 B4","","- B4 Ca5 Ni15 -","- B4 Ca5 Ni15 -","- B8 Ca10 Ni30 -","2","0.0833333","","Jung, W.; Weltzer, M.","Die ternaeren Calcium-Nickelboride Ca Ni4 B, Ca3 Ni7 B2, Ca5 Ni15 B4 und Ca Ni12 B6","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","169","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8103869","5.503","","5.105","","5.263","","120.21","","92.52","","116.33","","107.489","","","","","","","","","","","","","3","P -1","-P 1","2","","Cu (Sn F6)","","- Cu F6 Sn -","- Cu F6 Sn -","- Cu F6 Sn -","1","0.5","","Schroetter, F.; Mueller, B.G.","Zur Kristallstruktur ternaerer Cu(II)-Fluoride Cu M(IV) F6 (M(IV) = Sn, Pb, Ti, Mn, Pd)","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","261","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103885","5.283","","5.283","","5.283","","90","","90","","90","","147.449","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","K3 O I","","- I K3 O -","- I K3 O -","- I K3 O -","1","0.0208333","","Sitta, S.; Vogt, P.; Hippler, K.; Sabrowsky, H.","Crystal structure of K3OI","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","193","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103989","12.955","","13.705","","13.164","","90","","109.2","","90","","2207.24","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","H2 S2 O7","","- H2 O7 S2 -","- H2 O7 S2 -","- H32 O112 S32 -","16","2","","Hoenle, W.","Crystal structure of H2S2O7 at 298 K","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","279","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","162876","2020-10-21","18:00:00",""
"8104107","9.386","","9.386","","3.701","","90","","90","","120","","282.365","","","","","","","","","","","","","3","P -6","P -6","174","","Li3.2 Ni10.8 As7","","- As7 Li3.2 Ni10.8 -","- As7 Li3.2 Ni10.8 -","- As7 Li3.2 Ni10.8 -","1","0.166667","","Welzl, C.; Schuster, H.U.","Neue ternaere Alkaliphosphide und -arsenide des Nickels","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","179","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","164207","2020-10-21","18:00:00",""
"8104108","9.425","","9.425","","3.748","","90","","90","","120","","288.332","","","","","","","","","","","","","3","P -6","P -6","174","","Na2.3 Ni11.7 As7","","- As7 Na2.3 Ni11.7 -","- As7 Na2.3 Ni11.7 -","- As7 Na2.3 Ni11.7 -","1","0.166667","","Welzl, C.; Schuster, H.U.","Neue ternaere Alkaliphosphide und -arsenide des Nickels","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","179","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","164210","2020-10-21","18:00:00",""
"8104109","3.764","","3.764","","9.202","","90","","90","","90","","130.371","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Li Ni2 P2 -","- Li Ni2 P2 -","- Li2 Ni4 P4 -","2","0.0625","","Welzl, C.; Schuster, H.U.","Neue ternaere Alkaliphosphide und -arsenide des Nickels","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","179","192","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104128","5.127","","14.293","","8.425","","90","","92.64","","90","","616.731","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Fe Fe2 (S O4)4 (H2 O)2","","- Fe3 H4 O18 S4 -","- Fe3 H4 O18 S4 -","- Fe6 H8 O36 S8 -","2","0.5","","Wildner, M.; Giester, G.","Fe(II)Fe(III)2(SO4)4 * 2H2O: a new Fe(II)-Fe(III) sulfate, synthesis and crystal structure","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","269","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104294","9.749","","8.665","","18.74","","90","","121.25","","90","","1353.38","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","K5 (Sn Sb3)","","- K5 Sb3 Sn -","- K5 Sb3 Sn -","- K20 Sb12 Sn4 -","4","1","","Eisenmann, B.; Klein, J.","Dimere Zintl-Anionen (Sn2 As6)(10-) und (Sn2 Sb6)(10-) in Alkaliverbindungen.","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","213","229","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104316","18.289","","5.861","","12.988","","90","","134.82","","90","","987.527","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","(K5 Se3)3.8","","- K19 Se11.4 -","- K19 Se11.28 -","- K19 Se11.28 -","1","0.125","","Schewe-Miller, I.; Boettcher, P.","Synthesis and crystal structures of K5 Se3, Cs5 Te3, and Cs2 Te","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","137","151","","","","","","","","","","","","","","","","","","","","","","has coordinates","172083","2020-10-21","18:00:00",""
"8104339","5.917","0.001","4.758","0.001","6.441","0.001","90","","116.34","0.02","90","","162.56","","228.15","","228.15","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- N2 O4 -","- N2 O4 -","- N4 O8 -","2","0.5","","Obermeyer, A.; Borrmann, H.; Simon, A.","Die Phasenzusammenhänge zwischen kubischem und monoklinem N~2~O~4~","Zeitschrift für Kristallographie","1991","196","","129","135","10.1524/zkri.1991.196.14.129","","","","","","0.0382","0.0324","","0.0296","0.0299","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104456","8.598","","9.761","","9.159","","90","","91.385","","90","","768.445","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ba Zn2 (P O4)2","","- Ba O8 P2 Zn2 -","- Ba O8 P2 Zn2 -","- Ba4 O32 P8 Zn8 -","4","1","","Schmidt, R.; Kniep, R.","Crystal structure of barium dizinc phosphate","Zeitschrift fuer Kristallographie (149,1979-)","1991","196","","312","313","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""