B Au 
 1.0000000000000000
     8.8953530000000001    0.0000000000000000    0.0000000000000000
     4.4476769999999997    7.7036020000000001    0.0000000000000000
     0.0000000000000000    0.0000000000000000   33.8941190000000034
 B   Au 
   1  45
Selective dynamics
Cartesian
  4.4476699999999996  2.5678600000000000 13.6449999999999996   T   T   T
  4.4476699999999996  2.5678600000000000 11.6922899999999998   T   T   T
  5.9414400000000001  5.1500000000000004 11.5000599999999995   T   T   T
  7.4060400000000000  7.6867599999999996 11.5000599999999995   T   T   T
  7.4307499999999997  2.5704400000000001 11.5000599999999995   T   T   T
  8.8953600000000002  5.1357400000000002 11.4916300000000007   T   T   T
 10.3846600000000002  7.6867599999999996 11.5000599999999995   T   T   T
 10.3599499999999995  2.5704400000000001 11.5000599999999995   T   T   T
 11.8492599999999992  5.1500000000000004 11.5000599999999995   T   T   T
  0.0000000000000000  0.0000000000000000 11.4924199999999992   T   T   T
  1.4867699999999999  0.8583800000000000  9.0956299999999999   T   T   T
  2.9859300000000002  3.4117999999999999  9.1219999999999999   T   T   T
  4.4476800000000001  5.9868300000000003  9.0956299999999999   T   T   T
  4.4476699999999996  0.8799900000000000  9.1219999999999999   T   T   T
  5.9094100000000003  3.4117999999999999  9.1219999999999999   T   T   T
  7.4131099999999996  5.9915099999999999  9.0891300000000008   T   T   T
  7.4085900000000002  0.8583800000000000  9.0956299999999999   T   T   T
  8.8953500000000005  3.4241899999999998  9.0891300000000008   T   T   T
 10.3775999999999993  5.9915099999999999  9.0891300000000008   T   T   T
  2.9649999999999999  1.7118400000000000  6.7270799999999999   T   T   T
  4.4476800000000001  4.2799199999999997  6.7270799999999999   T   T   T
  5.9295799999999996  6.8480200000000000  6.7257199999999999   T   T   T
  5.9303600000000003  1.7118400000000000  6.7270799999999999   T   T   T
  7.4103100000000000  4.2783400000000000  6.7278099999999998   T   T   T
  8.8953600000000002  6.8505300000000000  6.7278099999999998   T   T   T
  8.8953500000000005  1.7111600000000000  6.7257199999999999   T   T   T
 10.3804099999999995  4.2783400000000000  6.7278099999999998   T   T   T
 11.8611299999999993  6.8480200000000000  6.7257199999999999   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