Au Ne 
 1.0000000000000000
     8.8953530000000001    0.0000000000000000    0.0000000000000000
     4.4476769999999997    7.7036020000000001    0.0000000000000000
     0.0000000000000000    0.0000000000000000   33.8941190000000034
 Au  Ne 
  45   1
Selective dynamics
Cartesian
  4.4476699999999996  2.5678600000000000 11.5041200000000003   T   T   T
  5.9304100000000002  5.1356500000000000 11.5062800000000003   T   T   T
  7.4129600000000000  7.7035000000000000 11.5062800000000003   T   T   T
  7.4127999999999998  2.5680600000000000 11.5062800000000003   T   T   T
  8.8953600000000002  5.1357400000000002 11.5056399999999996   T   T   T
 10.3777500000000007  7.7035000000000000 11.5062800000000003   T   T   T
 10.3779000000000003  2.5680600000000000 11.5062800000000003   T   T   T
 11.8603000000000005  5.1356500000000000 11.5062800000000003   T   T   T
  0.0000000000000000  0.0000000000000000 11.5059699999999996   T   T   T
  1.4823200000000001  0.8558200000000000  9.1007300000000004   T   T   T
  2.9653299999999998  3.4237000000000002  9.0996000000000006   T   T   T
  4.4476800000000001  5.9919700000000002  9.1007300000000004   T   T   T
  4.4476699999999996  0.8562000000000000  9.0996000000000006   T   T   T
  5.9300199999999998  3.4237000000000002  9.0996000000000006   T   T   T
  7.4130000000000003  5.9915700000000003  9.1001999999999992   T   T   T
  7.4130399999999996  0.8558200000000000  9.1007300000000004   T   T   T
  8.8953500000000005  3.4240599999999999  9.1001999999999992   T   T   T
 10.3777100000000004  5.9915700000000003  9.1001999999999992   T   T   T
  2.9644800000000000  1.7115400000000001  6.7281800000000000   T   T   T
  4.4476800000000001  4.2805200000000001  6.7281800000000000   T   T   T
  5.9304500000000004  6.8475200000000003  6.7288300000000003   T   T   T
  5.9308699999999996  1.7115400000000001  6.7281800000000000   T   T   T
  7.4124100000000004  4.2795500000000004  6.7285700000000004   T   T   T
  8.8953600000000002  6.8480999999999996  6.7285700000000004   T   T   T
  8.8953500000000005  1.7121599999999999  6.7288300000000003   T   T   T
 10.3783100000000008  4.2795500000000004  6.7285700000000004   T   T   T
 11.8602500000000006  6.8475200000000003  6.7288300000000003   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
  4.4476699999999996  2.5678600000000000 15.1934699999999996   T   T   T