 S Ca Sb
   1.0
    14.8736876799999997    0.0000000000000000   -0.1008811600000000
     0.0000000000000000    5.6443606400000004    0.0000000000000000
    -4.0533837999999998    0.0000000000000000   10.4918992200000005
 S Ca Sb
  20   8   8
Direct
   0.2995262000000000  0.2622869100000000  0.6556217400000000
   0.7004737999999999  0.7622869100000000  0.8443782600000000
   0.7004737999999999  0.7377130900000000  0.3443782600000000
   0.2995262000000000  0.2377130900000000  0.1556217400000000
   0.8818612500000000  0.2976143300000000  0.9394719100000000
   0.1181387500000000  0.7976143300000000  0.5605280900000000
   0.1181387500000000  0.7023856700000000  0.0605280900000000
   0.8818612500000000  0.2023856700000000  0.4394719100000000
   0.6946877000000000  0.2655372500000000  0.5973097300000000
   0.3053123000000000  0.7655372499999999  0.9026902700000000
   0.3053123000000000  0.7344627500000001  0.4026902700000000
   0.6946877000000000  0.2344627500000000  0.0973097300000000
   0.5005858300000000  0.0060279900000000  0.8458991800000000
   0.4994141700000000  0.5060279900000000  0.6541008200000000
   0.4994141700000000  0.9939720100000000  0.1541008200000000
   0.5005858300000000  0.4939720100000000  0.3458991800000000
   0.9006993400000000  0.7688677700000000  0.7197639700000000
   0.0993006600000000  0.2688677700000000  0.7802360300000000
   0.0993006600000000  0.2311322300000000  0.2802360300000000
   0.9006993400000000  0.7311322300000000  0.2197639700000000
   0.6649387400000000  0.2630629100000000  0.8329878600000000
   0.3350612600000000  0.7630629100000000  0.6670121400000000
   0.3350612600000000  0.7369370900000001  0.1670121400000000
   0.6649387400000000  0.2369370900000000  0.3329878600000000
   0.1059630600000000  0.7294271900000000  0.3047165800000000
   0.8940369400000000  0.2294271900000000  0.1952834200000000
   0.8940369400000000  0.2705728100000000  0.6952834200000000
   0.1059630600000000  0.7705728100000000  0.8047165800000000
   0.3812196000000000  0.1585757800000000  0.9423210700000000
   0.6187804000000000  0.6585757800000001  0.5576789300000000
   0.6187804000000000  0.8414242199999999  0.0576789300000000
   0.3812196000000000  0.3414242200000000  0.4423210700000000
   0.1215935400000000  0.2390348800000000  0.5704161200000000
   0.8784064600000000  0.7390348799999999  0.9295838800000000
   0.8784064600000000  0.7609651200000001  0.4295838800000000
   0.1215935400000000  0.2609651200000000  0.0704161200000000