Realgar Kyono A American Mineralogist 94 (2009) 451-460 Molecular conformation and anion configuration variations for As4S4 and As4Se4 in an anion-substituted solid solution Locality: synthetic Note: S1Se1-1 _database_code_amcsd 0004860 9.4342 13.6374 6.6443 90 106.523 90 P2_1/n atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) As1 .11910 -.01993 .76060 .0285 .0299 .0267 .0279 -.0041 .0064 -.0038 As2 .42416 .13982 .85844 .0284 .0251 .0294 .0320 -.0006 .0103 .0011 As3 .32232 .12847 .17723 .0280 .0267 .0340 .0227 -.0016 .0063 -.0041 As4 .03978 .16074 .71013 .0303 .0254 .0321 .0308 .0058 .0040 .0024 SX1 .34373 -.00869 .69754 .616 .0329 .0353 .0312 .0337 .0036 .0119 -.0007 SeX1 .34373 -.00869 .69754 .384 .0329 .0353 .0312 .0337 .0036 .0119 -.0007 SX2 .21391 -.02487 .11851 .587 .0310 .0302 .0323 .0308 -.0011 .0094 .0024 SeX2 .21391 -.02487 .11851 .413 .0310 .0302 .0323 .0308 -.0011 .0094 .0024 SX3 .24040 .22833 .63979 .781 .0306 .0328 .0296 .0314 .0030 .0119 .0068 SeX3 .24040 .22833 .63979 .219 .0306 .0328 .0296 .0314 .0030 .0119 .0068 SX4 .10824 .21377 .05416 .666 .0333 .0312 .0369 .0338 .0034 .0126 -.0044 SeX4 .10824 .21377 .05416 .334 .0333 .0312 .0369 .0338 .0034 .0126 -.0044