Au  S 
 1.0000000000000000
     8.8953530000000001    0.0000000000000000    0.0000000000000000
     4.4476769999999997    7.7036020000000001    0.0000000000000000
     0.0000000000000000    0.0000000000000000   33.8941190000000034
 Au  S  
  45   1
Selective dynamics
Cartesian
  4.4879800000000003  2.5911400000000002 11.4457900000000006   T   T   T
  5.9302299999999999  5.0891999999999999 11.4457900000000006   T   T   T
  7.5441399999999996  7.6277699999999999 11.6462800000000009   T   T   T
  7.3724900000000000  2.5911400000000002 11.4457900000000006   T   T   T
  8.9057700000000004  5.1417500000000000 11.4312699999999996   T   T   T
 10.3779199999999996  7.6915800000000001 11.4312699999999996   T   T   T
 10.3779100000000000  2.7195299999999998 11.6462800000000009   T   T   T
 11.8500599999999991  5.1417500000000000 11.4312699999999996   T   T   T
 13.2116799999999994  7.6277699999999999 11.6462800000000009   T   T   T
  1.4825600000000001  0.8559500000000000  9.1833799999999997   T   T   T
  2.9375100000000001  3.3989900000000000  9.1061999999999994   T   T   T
  4.4553799999999999  6.0280199999999997  9.1061999999999994   T   T   T
  4.4123599999999996  0.8444700000000001  9.1061999999999994   T   T   T
  5.9302299999999999  3.4238200000000001  9.0515399999999993   T   T   T
  7.4050900000000004  6.0280199999999997  9.1061999999999994   T   T   T
  7.4481000000000002  0.8444700000000001  9.1061999999999994   T   T   T
  8.9229599999999998  3.3989900000000000  9.1061999999999994   T   T   T
 10.3779199999999996  5.9916900000000002  9.0485100000000003   T   T   T
  2.9584000000000001  1.7080299999999999  6.7307199999999998   T   T   T
  4.4420999999999999  4.2830000000000004  6.7332400000000003   T   T   T
  5.9302299999999999  6.8554000000000004  6.7307199999999998   T   T   T
  5.9302400000000004  1.7054800000000001  6.7332400000000003   T   T   T
  7.4183700000000004  4.2830000000000004  6.7332400000000003   T   T   T
  8.8945799999999995  6.8480900000000000  6.7168400000000004   T   T   T
  8.9020700000000001  1.7080299999999999  6.7307199999999998   T   T   T
 10.3779199999999996  4.2788899999999996  6.7168400000000004   T   T   T
 11.8612500000000001  6.8480900000000000  6.7168400000000004   T   T   T
  4.4476699999999996  2.5678600000000000  4.3578000000000001   F   F   F
  5.9302299999999999  5.1357400000000002  4.3578000000000001   F   F   F
  2.9651100000000001  0.0000000000000000  4.3578000000000001   F   F   F
  7.4127999999999998  2.5678600000000000  4.3578000000000001   F   F   F
  8.8953600000000002  5.1357400000000002  4.3578000000000001   F   F   F
  5.9302400000000004  0.0000000000000000  4.3578000000000001   F   F   F
  1.4825600000000001  2.5678600000000000  4.3578000000000001   F   F   F
  2.9651200000000002  5.1357400000000002  4.3578000000000001   F   F   F
  0.0000000000000000  0.0000000000000000  4.3578000000000001   F   F   F
  1.4825600000000001  0.8559500000000000  1.9368099999999999   F   F   F
  2.9651100000000001  3.4238200000000001  1.9368099999999999   F   F   F
  4.4476800000000001  5.9916900000000002  1.9368099999999999   F   F   F
  4.4476699999999996  0.8559500000000000  1.9368099999999999   F   F   F
  5.9302299999999999  3.4238200000000001  1.9368099999999999   F   F   F
  7.4127900000000002  5.9916900000000002  1.9368099999999999   F   F   F
  7.4127999999999998  0.8559500000000000  1.9368099999999999   F   F   F
  8.8953500000000005  3.4238200000000001  1.9368099999999999   F   F   F
 10.3779199999999996  5.9916900000000002  1.9368099999999999   F   F   F
  1.4825600000000001  0.8559500000000000 13.1624900000000000   T   T   T