# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-30T19:12:12+02:00
# 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 'Canadian Mineralogist') AND volume = 16 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
"1530051","5.427","","5.427","","10.871","","90","","90","","90","","320.176","","","","","","","","","","","","","5","I -4","I -4","82","","Cu1.98 (Zn0.72 Fe0.28) Sn0.99 S4","","- Cu1.98 Fe0.28 S4 Sn0.99 Zn0.72 -","- Cu1.98 Fe0.28 S4 Sn0.99 Zn0.72 -","- Cu3.96 Fe0.56 S8 Sn1.98 Zn1.44 -","2","0.25","","Hall, S.R.; Szymanski, J.T.; Stewart, J.M.","Kesterite, Cu2 (Zn, Fe) Sn S4, and stannite, Cu2 (Fe, Zn) Sn S4, structurally similar but distinct minerals","Canadian Mineralogist","1978","16","","131","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","155014","2020-10-21","18:00:00",""
"1530075","9.923","","18.134","","5.352","","90","","104.84","","90","","930.936","","","","","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","Na2.09 Ca1.178 Mn.032 Mg.92 Fe4.07 (Si6.2 Al1.8 O20.7) (O H)3.3","","- Al1.8 Ca1.178 Fe4.07 H3.3 Mg0.92 Mn0.032 Na2.09 O24 Si6.2 -","- Al1.8 Ca1.178 Fe4.075 Mg0.925 Mn0.032 Na2.09 O24 Si6.2 -","- Al3.6 Ca2.356 Fe8.15 Mg1.85 Mn0.064 Na4.18 O48 Si12.4 -","2","0.25","","Hawthorne, F.C.; Grungy, H.D.","The crystal chemistry of the amphiboles. VII. The crystal structure and site chemistry of potassium ferri-taramite","Canadian Mineralogist","1978","16","","53","62","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530403","13.27","","13.91","","9.73","","90","","90","","90","","1796.02","","","","","","","","","","","","","7","C c m 21","C 2c -2c","36","","Y4 (Ca.75 La.25)4 (O H) (H2 O)5 (Si8 O20) (C O3)6 (H2 O)2","","- C6 H15 Ca3 La O46 Si8 Y4 -","- C6 Ca3 La O46 Si8 Y4 -","- C12 Ca6 La2 O92 Si16 Y8 -","2","0.25","","Mellini, M.; Merlino, S.","Caysichite. A double crankshaft chain structure","Canadian Mineralogist","1978","16","","81","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530856","5.487","","5.487","","10.848","","90","","90","","90","","326.603","","","","","","","","","","","","","6","I -4 2 m","I -4 2","121","","Cu2 (Cd0.37 Zn0.33 Fe0.29) Sn S4","","- Cd0.37 Cu2 Fe0.29 S4 Sn Zn0.33 -","- Cd0.37 Cu2 Fe0.29 S4 Sn Zn0.33 -","- Cd0.74 Cu4 Fe0.58 S8 Sn2 Zn0.66 -","2","0.125","","Szymanski, J.T.","The crystal structure of cernyite, Cu2 Cd Sn S4, a cadmium analogue of Stannite","Canadian Mineralogist","1978","16","","147","151","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540202","10.9806","","10.9806","","10.9806","","90","","90","","90","","1323.97","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- Cu5 Fe S4 -","- Cu5.0008 Fe0.9996 S4 -","- Cu40.0064 Fe7.9968 S32 -","8","0.0416667","","Kanazawa, Y.; Koto, K.; Morimoto, N.","Bornite Cu5 Fe S4. Stability and crystal structure of the intermediate form","Canadian Mineralogist","1978","16","","397","404","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"9004124","9.923","","18.134","","5.352","","90","","104.84","","90","","930.936","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Ferritaramite","- Al1.84 Ca1.178 Fe3.736 H2 K0.494 Mg0.885 Mn0.185 Na1.582 O24 Si6.2 Ti0.186 -","- Al1.84 Ca1.178 Fe3.736 H2 K0.494 Mg0.885 Mn0.185 Na1.582 O24 Si6.2 Ti0.186 -","- Al3.68 Ca2.356 Fe7.472 H4 K0.988 Mg1.77 Mn0.37 Na3.164 O48 Si12.4 Ti0.372 -","2","0.25","","Hawthorne, F. C.; Grundy, H. D.","The crystal chemistry of the amphiboles. VII. Crystal structure and site chemistry of potassian ferri-taramite","The Canadian Mineralogist","1978","16","","53","62","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9004125","9.152","","9.152","","9.152","","68.99","","68.99","","68.99","","644.342","","","","","","","","","","","","","8","R -3 :R","-P 3*","148","","","Landauite","- Fe2.16 K0.15 Mn Na0.7 O38 Pb0.15 Ti15.84 Zn2 -","- Fe2.16 K0.15 Mn Na0.7 O38 Pb0.15 Ti15.84 Zn2 -","- Fe2.16 K0.15 Mn Na0.7 O38 Pb0.15 Ti15.84 Zn2 -","1","0.166667","","Grey, I. E.; Gatehouse, B. M.","The crystal structure of landauite, Na[MnZn2(Ti,Fe)6Ti12]O38","The Canadian Mineralogist","1978","16","","63","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:06",""
"9004126","11.769","","6.684","","8.235","","90","","102.59","","90","","632.222","","","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","Hydroboracite","- B6 Ca H12 Mg O17 -","- B6 Ca H12 Mg O17 -","- B12 Ca2 H24 Mg2 O34 -","2","0.5","","Sabelli, C.; Stoppioni, A.","Refinement of the crystal structure of hydroboracite","The Canadian Mineralogist","1978","16","","75","80","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36",""
"9004127","13.27","","13.91","","9.73","","90","","90","","90","","1796.02","","","","","","","","","","","","","6","C c m 21","C 2c -2c","36","","","Caysichite-(Y)","- C3 H8.5 Ca1.5 O23 Si4 Y2.5 -","- C3 H7.5 Ca1.5 O23 Si4 Y2.5 -","- C12 H30 Ca6 O92 Si16 Y10 -","4","0.5","","Mellini, M.; Merlino, S.","Caysichite: A double crankshaft chain structure","The Canadian Mineralogist","1978","16","","81","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9004128","5.427","","5.427","","10.871","","90","","90","","90","","320.176","","","","","","","","","","","","","6","I -4","I -4","82","","","Kesterite","- Cd0.01 Cu2 Fe0.28 S4 Sn Zn0.71 -","- Cd0.01 Cu2 Fe0.28 S4 Sn Zn0.71 -","- Cd0.02 Cu4 Fe0.56 S8 Sn2 Zn1.42 -","2","0.25","","Hall, S. R.; Szymanski, J. T.; Stewart, J. M.","Kesterite, Cu2(Zn,Fe)SnS4, and stannite, Cu2(Fe,Zn)SnS4, structurally similar but distinct minerals","The Canadian Mineralogist","1978","16","","131","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004129","5.449","","5.449","","10.757","","90","","90","","90","","319.393","","","","","","","","","","","","","6","I -4 2 m","I -4 2","121","","","Stannite","- Cd0.02 Cu2 Fe0.8 S4 Sn Zn0.18 -","- Cd0.02 Cu2 Fe0.8 S4 Sn Zn0.18 -","- Cd0.04 Cu4 Fe1.6 S8 Sn2 Zn0.36 -","2","0.125","","Hall, S. R.; Szymanski, J. T.; Stewart, J. M.","Kesterite, Cu2(Zn,Fe)SnS4, and stannite, Cu2(Fe,Zn)SnS4, structurally similar but distinct minerals","The Canadian Mineralogist","1978","16","","131","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004130","5.487","","5.487","","10.848","","90","","90","","90","","326.603","","","","","","","","","","","","","7","I -4 2 m","I -4 2","121","","","Cernyite","- Cd0.37 Cu2 Fe0.29 Mn0.01 S4 Sn Zn0.33 -","- Cd0.37 Cu2 Fe0.29 Mn0.01 S4 Sn Zn0.33 -","- Cd0.74 Cu4 Fe0.58 Mn0.02 S8 Sn2 Zn0.66 -","2","0.125","","Szymanski, J. T.","The crystal structure of cernyite, Cu2CdSnS4, a cadmium analogue of stannite Note: z-coordinate for S atom changed in order to reproduce bond lengths.","The Canadian Mineralogist","1978","16","","147","151","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004131","8.062","","8.384","","5.881","","90","","90","","90","","397.507","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","","Libethenite","- Cu2 H O5 P -","- Cu2 H O5 P -","- Cu8 H4 O20 P4 -","4","0.5","","Cordsen, A.","A crystal-structure refinement of libethenite","The Canadian Mineralogist","1978","16","","153","157","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:44",""
"9004132","9.811","","18.013","","5.326","","90","","103.68","","90","","914.539","","","","","","","","","","","","Pikes Peak, Colorado, USA","11","C 1 2/m 1","-C 2y","12","","","Riebeckite","- Al0.354 Ca0.014 F1.253 Fe4.36 H0.892 K0.29 Li0.344 Mn0.182 Na2.024 O22.892 Si7.76 -","- Al0.354 Ca0.014 F1.253 Fe4.36 H0.892 K0.29 Li0.344 Mn0.182 Na2.024 O22.892 Si7.76 -","- Al0.708 Ca0.028 F2.506 Fe8.72 H1.784 K0.58 Li0.688 Mn0.364 Na4.048 O45.784 Si15.52 -","2","0.25","","Hawthorne, F. C.","The crystal chemistry of the amphiboles. VIII. The crystal structure and site chemistry of fluor-riebeckite","The Canadian Mineralogist","1978","16","","187","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10",""
"9004133","10.9806","","10.9806","","10.9806","","90","","90","","90","","1323.97","","","","458.15","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","Bornite","- Cu1.25 Fe0.25 S -","- Cu1.24999 Fe0.24999 S -","- Cu39.9997 Fe7.99968 S32 -","32","0.166667","","Kanazawa, Y.; Koto, K.; Morimoto, N.","Bornite (Cu5FeS4): Stability and crystal structure of the intermediate form Sample: T = 185 degree C","The Canadian Mineralogist","1978","16","","397","404","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004134","18.357","","12.591","","6.068","","90","","90","","90","","1402.52","","","","","","","","","","","","","5","P n n m","-P 2 2n","58","","","Orthopinakiolite","- B8 Fe1.76 Mg11.384 Mn10.446 O40 -","- B8 Fe1.76 Mg11.384 Mn10.446 O40 -","- B16 Fe3.52 Mg22.768 Mn20.892 O80 -","2","0.25","","Takeuchi, Y.; Haga, N.; Kato, T.; Miura, Y.","Orthopinakiolite, Me2.95O2[BO3]: its crystal structure and relationship to pinakiolite, Me2.90O2[BO3] Note: z-coordinate of O9 changed. y-coordinate of M7* changed.","The Canadian Mineralogist","1978","16","","475","485","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""