# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-08T14:58:29+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 'Scientific Reports') AND volume = 3 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
"1529337","9.83633","0.00033","9.06851","0.0003","5.34709","0.00018","90","","107.09","0.0017","90","","455.9","0.03","300","","300","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Eu0.12 Na3.88 O24 Sc4 Si8 -","- Ca0 Eu0.12 Mg0 Na3.88 O24 Sc4 Si8 -","- Ca0 Eu0.12 Mg0 Na3.88 O24 Sc4 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","2.47","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529338","9.81825","0.0002","9.04929","0.00019","5.32748","0.0001","90","","106.713","0.0012","90","","453.342","0.016","300","","300","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- Ca0.68 Eu0.12 Mg0.7 Na3.2 O24 Sc3.3 Si8 -","- Ca0.6748 Eu0.12 Mg0.696 Na3.2052 O24 Sc3.304 Si8 -","- Ca0.6748 Eu0.12 Mg0.696 Na3.2052 O24 Sc3.304 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.973","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529339","9.77208","0.0003","8.97795","0.00029","5.27439","0.00017","90","","106.014","0.0012","90","","444.78","0.02","300","","300","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- Ca2.94 Eu0.2 Mg3.1 Na0.86 O24 Sc0.9 Si8 -","- Ca2.9444 Eu0.2 Mg3.0992 Na0.8556 O24 Sc0.9008 Si8 -","- Ca2.9444 Eu0.2 Mg3.0992 Na0.8556 O24 Sc0.9008 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.726","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529340","9.79577","0.0002","9.01952","0.00019","5.30306","0.00011","90","","106.359","0.0012","90","","449.574","0.016","300","","300","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- Ca1.66 Eu0.12 Mg1.71 Na2.22 O24 Sc2.29 Si8 -","- Ca1.658 Eu0.12 Mg1.7092 Na2.222 O24 Sc2.2908 Si8 -","- Ca1.658 Eu0.12 Mg1.7092 Na2.222 O24 Sc2.2908 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.576","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529341","9.78235","0.00044","8.99721","0.00041","5.28777","0.00023","90","","106.133","0.0014","90","","447.07","0.03","300","","300","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- Ca2.36 Eu0.12 Mg2.44 Na1.52 O24 Sc1.56 Si8 -","- Ca2.3628 Eu0.12 Mg2.4356 Na1.5172 O24 Sc1.5644 Si8 -","- Ca2.3628 Eu0.12 Mg2.4356 Na1.5172 O24 Sc1.5644 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.778","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529342","9.76484","0.00023","8.97439","0.00021","5.26841","0.00012","90","","105.979","0.0011","90","","443.85","0.018","300","","300","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- Ca3.13 Eu0.12 Mg3.23 Na0.75 O24 Sc0.77 Si8 -","- Ca3.1296 Eu0.12 Mg3.2264 Na0.7504 O24 Sc0.7736 Si8 -","- Ca3.1296 Eu0.12 Mg3.2264 Na0.7504 O24 Sc0.7736 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.659","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1529343","9.74888","0.00017","8.9529","0.00016","5.250985","0.000093","90","","105.864","0.00091","90","","440.855","0.014","300","","300","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ca3.88 Eu0.12 O24 Si8 -","- Ca3.88 Eu0.12 Mg4 Na0 O24 Sc0 Si8 -","- Ca3.88 Eu0.12 Mg4 Na0 O24 Sc0 Si8 -","1","0.125","","Z. Xia; Yu. Zhang; M.S. Molokeev; V.V. Atuchin; Y. Luo","Linear structural evolution induced tunable photoluminescence in clinopyroxene solid-solution phosphors","Scientific Reports","2013","3","3310","1","7","10.1038/srep03310","powder diffraction","x-ray","1.5406","CuKα~1~~2~","","","","","","","","","1.379","1.455","","","","","","","has coordinates,has Fobs","205493","2020-10-21","18:00:00",""
"1547347","4.9877","","4.9877","","17.053","0.0003","90","","90","","120","","367.394","0.006","294","","294","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O -","- C0.166667 Ca0.166667 O0.5 -","- C6 Ca6 O18 -","36","1","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0134","0.0133","","","0.0201","0.0201","","","","1.69","1.69","1.68","","","","has coordinates","288072","2023-12-06","13:08:11",""
"1547348","4.988","","4.988","","17.0607","0.0003","90","","90","","120","","367.604","0.006","294","","294","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O -","- C0.166667 Ca0.166667 O0.5 -","- C6 Ca6 O18 -","36","1","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0181","0.0177","","","0.024","0.0241","","","","1.85","1.85","1.83","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547349","4.986","","4.986","","17.0592","0.0003","90","","90","","120","","367.277","0.006","294","","294","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O -","- C0.166667 Ca0.166667 O0.5 -","- C6 Ca6 O18 -","36","1","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.018","0.0173","","","0.023","0.0231","","","","1.81","1.81","1.77","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547350","4.9876","","4.9876","","17.0575","0.0005","90","","90","","120","","367.476","0.011","295","","295","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0207","0.0207","","","0.0264","0.0264","","","","2.18","2.18","2.17","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547351","4.9804","0.0001","4.9804","0.0001","17.1932","0.0005","90","","90","","120","","369.331","0.015","580","","580","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71069","MoKα","","0.0277","0.0277","","","0.0308","0.0308","","","","2.39","2.39","2.39","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547352","4.978","0.0001","4.978","0.0001","17.2509","0.0005","90","","90","","120","","370.213","0.015","683","","683","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71069","MoKα","","0.0171","0.0171","","","0.0273","0.0273","","","","2.16","2.16","2.16","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547353","4.9763","0.0001","4.9763","0.0001","17.3134","0.0005","90","","90","","120","","371.301","0.015","787","","787","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71069","MoKα","","0.0271","0.0269","","","0.0342","0.0344","","","","2.68","2.68","2.67","","","","has coordinates","301779","2025-08-18","16:06:52",""
"1547354","4.9768","","4.9768","","17.3026","0.0004","90","","90","","120","","371.144","0.009","787","","787","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O -","- C0.166667 Ca0.166667 O0.5 -","- C6 Ca6 O18 -","36","1","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0141","0.0141","","","0.0197","0.0197","","","","1.61","1.61","1.6","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547355","4.9756","","4.9756","","17.3717","0.0003","90","","90","","120","","372.446","0.006","891","","891","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O -","- C0.166667 Ca0.166667 O0.5 -","- C6 Ca6 O18 -","36","1","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0174","0.0159","","","0.022","0.0223","","","","1.58","1.58","1.52","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547356","4.9752","","4.9752","","17.445","0.0004","90","","90","","120","","373.958","0.009","974","","974","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O -","- C0.166667 Ca0.166667 O0.5 -","- C6 Ca6 O18 -","36","1","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0335","0.0283","","","0.032","0.0328","","","","2.13","2.13","1.94","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547370","4.9747","","4.9747","","17.4468","0.0003","90","","90","","120","","373.921","0.006","995","","995","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0207","0.0197","","","0.0239","0.0243","","","","1.89","1.89","1.81","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547371","4.9694","","4.9694","","17.758","0.0003","90","","90","","120","","379.78","0.006","1213","","1213","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0551","0.0388","","","0.0558","0.0683","","","","1.43","1.43","1.27","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547372","4.9679","","4.9679","","17.809","0.0003","90","","90","","120","","380.641","0.006","1234","","1234","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.045","0.0341","","","0.0562","0.0574","","","","4.37","4.37","3.66","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547373","4.9745","","4.9745","","17.4912","0.0003","90","","90","","120","","374.843","0.006","1037","","1037","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0243","0.0217","","","0.025","0.0256","","","","1.72","1.72","1.63","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547374","4.9746","","4.9746","","17.5316","0.0003","90","","90","","120","","375.724","0.006","1058","","1058","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0279","0.0213","","","0.0262","0.0278","","","","1.65","1.65","1.48","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547375","4.9738","","4.9738","","17.5413","0.0003","90","","90","","120","","375.811","0.006","1078","","1078","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0229","0.0201","","","0.025","0.0255","","","","1.73","1.73","1.6","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547376","4.9738","","4.9738","","17.5547","0.0003","90","","90","","120","","376.098","0.006","1099","","1099","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0243","0.0201","","","0.0261","0.0269","","","","1.81","1.81","1.67","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547377","4.9738","","4.9738","","17.5798","0.0003","90","","90","","120","","376.635","0.006","1120","","1120","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0271","0.0225","","","0.0275","0.0287","","","","1.89","1.89","1.76","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547378","4.9725","","4.9725","","17.6257","0.0003","90","","90","","120","","377.421","0.006","1151","","1151","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0221","0.0211","","","0.0295","0.0297","","","","2.3","2.3","2.17","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547379","4.9728","","4.9728","","17.6811","0.0003","90","","90","","120","","378.653","0.006","1182","","1182","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0322","0.0249","","","0.0334","0.0345","","","","2.27","2.27","1.96","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547380","4.9714","","4.9714","","17.6902","0.0003","90","","90","","120","","378.635","0.006","1192","","1192","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- C Ca O3 -","- C Ca O3 -","- C6 Ca6 O18 -","6","0.166667","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0262","0.0235","","","0.0326","0.0333","","","","2.58","2.58","2.39","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547381","4.9699","","4.9699","","8.9166","","90","","90","","120","","190.733","","1254","","1254","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- C Ca O3 -","- C Ca O3 -","- C3 Ca3 O9 -","3","0.0833333","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0345","0.024","","","0.0287","0.0312","","","","1.91","1.91","1.63","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1547382","4.9689","","4.9689","","8.9364","","90","","90","","120","","191.079","","1275","","1275","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- C Ca O3 -","- C Ca O3 -","- C3 Ca3 O9 -","3","0.0833333","","Nobuo Ishizawa; Hayato Setoguchi; Kazumichi Yanagisawa","Structural evolution of calcite at high temperatures: Phase V unveiled","Scientific Reports","2013","3","","2832","","10.1038/srep02832","","x-ray","0.71073","MoKα","","0.0394","0.0251","","","0.0284","0.031","","","","1.86","1.86","1.57","","","","has coordinates","288072","2023-12-06","13:08:12",""
"1548604","19.957","0.004","9.858","0.002","15.78","0.003","90","","99.02","0.03","90","","3066.1","1.1","","","173","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 N2 O7 -","- C12 N2 O7 -","- C96 N16 O56 -","8","1","","Yu-Qiang Zhou; Nai-Xing Wang; Yalan Xing; Yan-Jing Wang; Xiao-Wei Hong; Jia-Xiang Zhang; Dong-Dong Chen; Jing-Bo Geng; Yanfeng Dang; Zhi-Xiang Wang","Stable acyclic aliphatic solid enols: synthesis, characterization, X-ray structure analysis and calculations","Scientific Reports","2013","3","","1058","","10.1038/srep01058","","x-ray","0.71073","MoKα","","0.0941","0.0862","","","0.2161","0.222","","","","","","1.215","","","","has coordinates","204751","2020-10-21","18:00:00",""
"1548605","8.6838","0.0017","8.8343","0.0018","10.114","0.002","80.33","0.03","72.94","0.03","67.07","0.03","681.9","0.3","","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H18 N2 O6 -","- C11 N2 O6 -","- C22 N4 O12 -","2","1","","Yu-Qiang Zhou; Nai-Xing Wang; Yalan Xing; Yan-Jing Wang; Xiao-Wei Hong; Jia-Xiang Zhang; Dong-Dong Chen; Jing-Bo Geng; Yanfeng Dang; Zhi-Xiang Wang","Stable acyclic aliphatic solid enols: synthesis, characterization, X-ray structure analysis and calculations","Scientific Reports","2013","3","","1058","","10.1038/srep01058","","x-ray","0.71073","MoKα","","0.0736","0.0653","","","0.1665","0.1736","","","","","","1.157","","","","has coordinates","204752","2020-10-21","18:00:00",""