# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T15:29:15+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 fur Kristallographie') AND volume = 179 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
"5000046","6.5456","0.0007","9.451","0.002","5.6492","0.0008","90","","89.84","0.01","90","","349.5","","","","","","","","","","","","","3","C 1 1 21/d","","14","","Iron arsenic sulfide","Arsenopyrite","?","- As Fe S -","- As8 Fe8 S8 -","8","","","Fuess, H; Kratz, T; Toepel-Schadt, J; Miehe, G","","Zeitschrift fuer Kristallographie (149,1979-)","1987","179","","335","346","","","","","","","","","","","","","","","","","","","","","","has coordinates","77586","2020-10-21","18:00:00",""
"8103416","5.894","","6.843","","8.85","","106.28","","98.94","","95.83","","334.481","","","","","","","","","","","","","4","P -1","-P 1","2","","Ag9 (Ge O4)2 (N O3)","","- Ag9 Ge2 N O11 -","- Ag9 Ge2 N O11 -","- Ag9 Ge2 N O11 -","1","0.5","","Jansen, M.; Heidebrecht, K.","Syntheses and crystal structures of (Ag4XO4)2 AgNO3 (X = Si, Ge)","Zeitschrift fuer Kristallographie (149,1979-)","1987","179","","347","356","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103417","5.768","","6.768","","8.843","","107.03","","99.87","","94.16","","322.417","","","","","","","","","","","","","4","P -1","-P 1","2","","Ag9 (Si O4)2 N O3","","- Ag9 N O11 Si2 -","- Ag9 N O11 Si2 -","- Ag9 N O11 Si2 -","1","0.5","","Jansen, M.; Heidebrecht, K.","Syntheses and crystal structures of (Ag4Xo4)2 AgNo3 (X=Si, Ge)","Zeitschrift fuer Kristallographie (149,1979-)","1987","179","","347","356","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"9008379","8.809","","6.187","","7.509","","90","","118.74","","90","","358.835","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","Natrochalcite","- Cu2 H5 Na O10 S2 -","- Cu2 H3 Na O10 S2 -","- Cu4 H6 Na2 O20 S4 -","2","0.25","","Giester, G.; Zemann, J.","The crystal structure of the natrochalcite-type compounds Me+Cu2(OH)(zO4)2*H2O [Me+ = Na,K,Rb; z = S,Se], with special reference to the hydrogen bonds Locality: synthetic","Zeitschrift fur Kristallographie","1987","179","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9008380","9.246","","6.483","","7.94","","90","","116.11","","90","","427.369","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","","- Cu2 H5 O10 Rb Se2 -","- Cu2 H3 O10 Rb Se2 -","- Cu4 H6 O20 Rb2 Se4 -","2","0.25","","Giester, G.; Zemann, J.","The crystal structure of the natrochalcite-type compounds (Me+)Cu2(OH)(zO4)2*H2O [Me+ = Na,K,Rb; z = S,Se], with special reference to the hydrogen bonds Locality: synthetic","Zeitschrift fur Kristallographie","1987","179","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9008381","9.005","","6.305","","7.802","","90","","116.22","","90","","397.391","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","","- Cu2 H5 O10 Rb S2 -","- Cu2 H3 O10 Rb S2 -","- Cu4 H6 O20 Rb2 S4 -","2","0.25","","Giester, G.; Zemann, J.","The crystal structure of the natrochalcite-type compounds (Me+)Cu2(OH)(zO4)2*H2O [Me+ = Na,K,Rb; z = S,Se], with special reference to the hydrogen bonds Locality: synthetic","Zeitschrift fur Kristallographie","1987","179","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9008382","9.186","","6.423","","7.83","","90","","117.26","","90","","410.674","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","","- Cu2 H5 K O10 Se2 -","- Cu2 H3 K O10 Se2 -","- Cu4 H6 K2 O20 Se4 -","2","0.25","","Giester, G.; Zemann, J.","The crystal structure of the natrochalcite-type compounds (Me+)Cu2(OH)(zO4)2*H2O [Me+ = Na,K,Rb; z = S,Se], with special reference to the hydrogen bonds Locality: synthetic","Zeitschrift fur Kristallographie","1987","179","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9008383","9.063","","6.303","","7.678","","90","","118.45","","90","","385.631","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","","- Cu2 H5 Na O10 Se2 -","- Cu2 H3 Na O10 Se2 -","- Cu4 H6 Na2 O20 Se4 -","2","0.25","","Giester, G.; Zemann, J.","The crystal structure of the natrochalcite-type compounds (Me+)Cu2(OH)(zO4)2*H2O [Me+ = Na,K,Rb; z = S,Se], with special reference to the hydrogen bonds Locality: synthetic","Zeitschrift fur Kristallographie","1987","179","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9008384","8.955","","6.265","","7.628","","90","","117.45","","90","","379.772","","","","","","","","","","","","Synthetic","5","C 1 2/m 1","-C 2y","12","","","Kaliochalcite","- Cu2 H6 K O10 S2 -","- Cu2 H4 K O10 S2 -","- Cu4 H8 K2 O20 S4 -","2","0.25","","Giester, G.; Zemann, J.","The crystal structure of the natrochalcite-type compounds (Me+)Cu2(OH)(zO4)2*H2O [Me+ = Na,K,Rb; z = S,Se], with special reference to the hydrogen bonds Locality: synthetic","Zeitschrift fur Kristallographie","1987","179","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9011486","14.079","","14.203","","13.47","","90","","101.05","","90","","2643.58","","","","","","","","","","","","Iba, near Richelsdorf, Hessen, Germany","7","C 1 2/m 1","-C 2y","12","","","Richelsdorfite","- As4 Ca2 Cl Cu5 H18 O28 Sb -","- As4 Ca2 Cl Cu5 H18 O28 Sb -","- As16 Ca8 Cl4 Cu20 H72 O112 Sb4 -","4","0.5","","Susse, P.; Tillmann, B.","The crystal structure of the new mineral richelsdorfite, Ca2Cu5Sb(Cl/(OH)6/(AsO4)4)*6H2O","Zeitschrift fur Kristallographie","1987","179","","323","334","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011487","6.5456","","9.451","","5.6492","","90","","90","","89.84","","349.472","","","","","","","","","","","","","4","C 1 1 21/d","","","","","Arsenopyrite","- As0.91 Co0.13 Fe0.87 S1.09 -","- As0.91 Co0.13 Fe0.87 S1.09 -","- As7.28 Co1.04 Fe6.96 S8.72 -","8","","","Fuess, H.; Kratz, T.; Topel-Schadt J; Miehe, G.","Crystal structure refinement and electron microscopy of arsenopyrite Locality: Hakansboda, Sweden","Zeitschrift fur Kristallographie","1987","179","","335","346","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9013408","5.741","","5.649","","5.756","","90","","110.588","","90","","174.75","","","","","","","","","","","","Hakansboda, Sweden","4","P 1 21/c 1","-P 2ybc","14","","","Arsenopyrite","- As0.91 Co0.13 Fe0.87 S1.09 -","- As0.91 Co0.13 Fe0.87 S1.09 -","- As3.64 Co0.52 Fe3.48 S4.36 -","4","1","","Fuess, H.; Kratz, T.; Topel-Schadt J; Miehe, G.","Crystal structure refinement and electron microscopy of arsenopyrite Note: structure was transformed to this setting from C2_1/d","Zeitschrift fur Kristallographie","1987","179","","335","346","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""