H  O 
 1.0000000000000000
     4.3654005020355946   -0.0000000000000000    1.6055438529548840
    -0.0000000000000000    4.8127490010362237    0.0000000000000000
    -0.9844302077857855    0.0000000000000000    2.3461352162789360
 H   O  
   8   4
Selective dynamics
Cartesian
  0.7842560770863107  4.5232790489166828  0.5071255718246370   T   T   T
  2.5967142171634907  2.1169045483985656  3.4445534974091876   T   T   T
  1.1811422433193666  1.7058932070357884  0.6932029230609050   T   T   T
  2.1998280509304400  4.1122677075539000  3.2584761461729168   T   T   T
  3.6590773484935930  0.9390835753168043  2.8894210964150076   T   T   T
 -0.2781070542437864  3.3454580758349128  1.0622579728188202   T   T   T
  1.8823764278498230  0.8541946570672583  1.9612260623142230   T   T   T
  1.4985938663999763  3.2605691575853610  1.9904530069195965   T   T   T
  1.7993292630496016  0.9494915252214374  0.9667598903874498   T   T   T
  1.5816410312002060  3.3558660257395521  2.9849191788463729   T   T   T
  3.5696991837414824  1.8567432387500069  3.2971549337600536   T   T   T
 -0.1887288894916739  4.2631177392681128  0.6545241354737749   T   T   T