Scawtite
Zhang L, Fu P, Yang H, Yu K, Zhou Z
Chinese Science Bulletin 37 (1992) 930-934
Crystal structure of Scawtite
Locality: Zoulou iron deposit, Anhui Province, China
_database_code_amcsd 0020470
10.0394 15.1935 6.6344 90 115.645 90 Cm
atom     x     y     z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1  .9971     0 .4714 .009   .008   .007   .011      0   .002      0
Ca2  .1970 .1356 .0004 .010   .013   .007   .008  -.001   .002   .000
Ca3  .9908 .2509 .4863 .008   .008   .007   .007   .000   .002   .000
Ca4  .7731 .1447 .9757 .009   .009   .008   .008   .001   .002   .000
Si1  .7187 .1040 .4209 .005   .005   .006   .005   .001   .001   .000
Si2  .4889 .1765 .9845 .006   .005   .008   .005   .000   .002   .000
Si3  .2650 .1042 .5548 .006   .006   .006   .006  -.001   .003   .000
C        0     0     0 .013   .008   .023   .008      0   .002      0
O1   .8491 .1233 .3785 .010   .008   .010   .013   .000   .005   .002
O2   .7268     0 .5009 .012   .020   .006   .010      0   .006      0
O3   .5921 .1087 .1720 .013   .011   .014   .008   .005  -.003   .002
O4   .6896 .1616 .5955 .011   .015   .010   .009   .003   .006   .000
O5   .5750 .2349 .8899 .011   .011   .013   .011  -.002   .006  -.001
O6   .3974 .2274 .0793 .010   .011   .011   .013   .002   .008   .000
O7   .3986 .1046 .7953 .013   .013   .011   .010  -.002  -.001   .000
O8   .2925 .1614 .3796 .012   .016   .012   .008  -.005   .004   .001
O9   .1392 .1270 .6063 .010   .008   .010   .013   .000   .005  -.001
O10  .2448     0 .4689 .010   .016   .006   .007      0   .003      0
O11  .9760 .0722 .0673 .073   .040   .096   .047   .048  -.015  -.047
O12  .0601     0 .8750 .027   .014   .057   .011      0   .006      0
O13  .3451     0 .1331 .017   .019   .014   .023      0   .013      0
O14  .6566     0 .8528 .015   .018   .013   .015      0   .009      0
H13a .2860     0  .205 .081
H13b .4337     0 .2541 .063
H14a .6503     0 .7039 .035
H14b .5649     0 .8321 .033