 Si S Cu
   1.0
     6.2539173000000003    0.0000000000000000   -0.0111615800000000
     0.0000000000000000   10.9956907699999995    0.0000000000000000
    -1.9767419799999999    0.0000000000000000    5.9325919100000002
 Si S Cu
   4  12   8
Direct
   0.4758384000000000  0.5855001600000000  0.9793711600000000
   0.9758384000000000  0.9144998400000000  0.4793711600000000
   0.9758384000000000  0.0855001600000000  0.9793711600000000
   0.4758384000000000  0.4144998400000000  0.4793711600000000
   0.6162751100000000  0.7413255100000000  0.8807016800000000
   0.1162751100000000  0.7586744900000000  0.3807016800000000
   0.6131598500000000  0.5765126400000000  0.3568135600000000
   0.1131598500000000  0.9234873600000000  0.8568135600000000
   0.1213524100000000  0.5851311100000001  0.8819760200000000
   0.6213524100000001  0.9148688900000000  0.3819760200000000
   0.1162751100000000  0.2413255100000000  0.8807016800000000
   0.6162751100000000  0.2586744900000000  0.3807016800000000
   0.1131598500000000  0.0765126400000000  0.3568135600000000
   0.6131598500000000  0.4234873600000000  0.8568135600000000
   0.6213524100000001  0.0851311100000000  0.8819760200000000
   0.1213524100000000  0.4148688900000000  0.3819760200000000
   0.9972122200000000  0.7565521600000000  0.0025258900000000
   0.4972122200000000  0.7434478400000000  0.5025258900000000
   0.9982620500000000  0.5864771900000000  0.5013116600000000
   0.4982620500000000  0.9135228100000000  0.0013116600000000
   0.4972122200000000  0.2565521600000000  0.0025258900000000
   0.9972122200000000  0.2434478400000000  0.5025258900000000
   0.4982620500000000  0.0864771900000000  0.5013116600000000
   0.9982620500000000  0.4135228100000000  0.0013116600000000