 O Si S Ca
   1.0
     6.8123544000000003    0.0000000000000000    0.0000000000000000
     0.0000000000000000   15.3146119400000007    0.0000000000000000
     0.0000000000000000    0.0000000000000000   10.1300935400000007
 O Si S Ca
  48   8   4  20
Direct
   0.4661584500000000  0.3894869800000000  0.0436542500000000
   0.9661584500000000  0.1105130200000000  0.4563457500000000
   0.0338415500000000  0.6105130200000000  0.5436542500000000
   0.5338415500000000  0.8894869800000000  0.9563457500000000
   0.5338415500000000  0.6105130200000000  0.9563457500000000
   0.0338415500000000  0.8894869800000000  0.5436542500000000
   0.9661584500000000  0.3894869800000000  0.4563457500000000
   0.4661584500000000  0.1105130200000000  0.0436542500000000
   0.7137523500000000  0.3452018300000000  0.2321167800000000
   0.2137523500000000  0.1547981700000000  0.2678832200000000
   0.7862476500000000  0.6547981700000001  0.7321167800000000
   0.2862476500000000  0.8452018299999999  0.7678832200000000
   0.2862476500000000  0.6547981700000001  0.7678832200000000
   0.7862476500000000  0.8452018299999999  0.7321167800000000
   0.2137523500000000  0.3452018300000000  0.2678832200000000
   0.7137523500000000  0.1547981700000000  0.2321167800000000
   0.8193242800000000  0.4498801800000000  0.0220134600000000
   0.3193242800000000  0.0501198200000000  0.4779865400000000
   0.6806757200000000  0.5501198199999999  0.5220134599999999
   0.0651925000000000  0.3301652200000000  0.8523236900000000
   0.1806757200000000  0.9498801800000000  0.9779865400000000
   0.6806757200000000  0.9498801800000000  0.5220134599999999
   0.3193242800000000  0.4498801800000000  0.4779865400000000
   0.8193242800000000  0.0501198200000000  0.0220134600000000
   0.6103252600000000  0.5092974300000002  0.2316800300000000
   0.1103252600000000  0.9907025699999999  0.2683199700000000
   0.8896747400000000  0.4907025700000000  0.7316800299999999
   0.3896747400000000  0.0092974300000000  0.7683199700000000
   0.3896747400000000  0.4907025700000000  0.7683199700000000
   0.8896747400000000  0.0092974300000000  0.7316800299999999
   0.1103252600000000  0.5092974300000002  0.2683199700000000
   0.6103252600000000  0.9907025699999999  0.2316800300000000
   0.7660623200000000  0.2500000000000000  0.8959494200000000
   0.2660623200000000  0.2500000000000000  0.6040505800000000
   0.7339376799999999  0.7500000000000000  0.3959494200000000
   0.2339376800000000  0.7500000000000000  0.1040505800000000
   0.0421777500000000  0.2500000000000000  0.0544287000000000
   0.5421777500000000  0.2500000000000000  0.4455713000000000
   0.4578222500000000  0.7500000000000000  0.5544287000000000
   0.9578222500000000  0.7500000000000000  0.9455713000000000
   0.0651925000000000  0.1698347800000000  0.8523236900000000
   0.5651925000000000  0.3301652200000000  0.6476763100000000
   0.4348075000000000  0.8301652200000000  0.3523236900000000
   0.9348075000000000  0.6698347800000000  0.1476763100000000
   0.9348075000000000  0.8301652200000000  0.1476763100000000
   0.4348075000000000  0.6698347800000000  0.3523236900000000
   0.5651925000000000  0.1698347800000000  0.6476763100000000
   0.1806757200000000  0.5501198199999999  0.9779865400000000
   0.6525928200000000  0.0745726600000000  0.1330526300000000
   0.1525928200000000  0.4254273400000000  0.3669473700000000
   0.8474071800000000  0.9254273400000000  0.6330526300000000
   0.3474071800000000  0.5745726600000001  0.8669473700000000
   0.6525928200000000  0.4254273400000000  0.1330526300000000
   0.1525928200000000  0.0745726600000000  0.3669473700000000
   0.8474071800000000  0.5745726600000001  0.6330526300000000
   0.3474071800000000  0.9254273400000000  0.8669473700000000
   0.9822426200000000  0.2500000000000000  0.9130255000000000
   0.4822426200000000  0.2500000000000000  0.5869745000000000
   0.5177573799999999  0.7500000000000000  0.4130255000000000
   0.0177573800000000  0.7500000000000000  0.0869745000000000
   0.6361694900000000  0.4133133200000000  0.4322866500000000
   0.1361694900000000  0.0866866800000000  0.0677133500000000
   0.8638305100000000  0.5866866800000000  0.9322866500000000
   0.3638305100000000  0.9133133200000000  0.5677133500000000
   0.3638305100000000  0.5866866800000000  0.5677133500000000
   0.8638305100000000  0.9133133200000000  0.9322866500000000
   0.1361694900000000  0.4133133200000000  0.0677133500000000
   0.6361694900000000  0.0866866800000000  0.4322866500000000
   0.8564337200000001  0.5966307399999999  0.3407874300000000
   0.3564337200000000  0.9033692600000000  0.1592125700000000
   0.6435662799999999  0.4033692600000000  0.8407874300000000
   0.1435662800000000  0.0966307400000000  0.6592125700000000
   0.1435662800000000  0.4033692600000000  0.6592125700000000
   0.6435662799999999  0.0966307400000000  0.8407874300000000
   0.3564337200000000  0.5966307399999999  0.1592125700000000
   0.8564337200000001  0.9033692600000000  0.3407874300000000
   0.0487309600000000  0.7500000000000000  0.6900137800000000
   0.5487309600000000  0.7500000000000000  0.8099862200000000
   0.4512690400000000  0.2500000000000000  0.1900137800000000
   0.9512690400000000  0.2500000000000000  0.3099862200000000