Sulphur
Templeton L K, Templeton D H, Zalkin A
Inorganic Chemistry 15 (1976) 1999-2001
Crystal structure of monoclinic sulfur
Locality: synthetic
Note: this is known as the beta phase of sulfur
_database_code_amcsd 0012682
10.926 10.855 10.790 90 95.92 90 P2_1/c
atom      x      y      z occ  B(1,1)  B(2,2)  B(3,3)   B(1,2)   B(1,3)   B(2,3)
S1    .2333  .5251  .0299     .009949 .008168 .010613  .001208  .000364  .001352
S2    .1538  .3555  .0070     .007281 .012475 .013131 -.002119 -.000664  .001330
S3    .2572  .2523 -.1022     .012467 .009781 .008812 -.001462 -.003837 -.000687
S4    .3720  .1439  .0134     .012870 .006153 .010895 -.001738 -.002486  .000172
S5    .5398  .2283  .0381     .008996 .008211 .007510  .000911  .000429 -.000494
S6    .5531  .3154  .2075     .009843 .008656 .006272 -.000127 -.001693  .000515
S7    .5133  .4979  .1780     .009568 .007214 .009094 -.001992  .000043 -.001330
S8    .3317  .5246  .2023     .011324 .009505 .008226  .000106  .001972 -.002382
S9    .1783 -.1083  .0823  .5 .007620 .011881 .019317  .000636 -.003215  .001502
S10   .0505 -.0710  .2039  .5 .016087 .014215 .011720 -.001272 -.002786  .006009
S11   .0074  .1125  .1880  .5 .017145 .012306 .008248 -.000424 -.003858 -.001717
S12  -.1553  .1273  .0790  .5 .009737 .013367 .009984  .001483  .002572 -.000215
S13  -.1199  .1709 -.0981  .5 .010795 .009548 .009333  .000848 -.000643  .002575
S14  -.1266  .0105 -.1966  .5 .010372 .016549 .008899  .000424 -.002143 -.003219
S15   .0510 -.0466 -.2030  .5 .011642 .017186 .012371  .000000  .004501 -.002790
S16   .0899 -.1822 -.0743  .5 .009949 .008911 .020619  .000424  .000643 -.002790