H  O 
 1.0000000000000000
     3.4849271965228366   -0.0000000000000000   -0.0000000000000000
    -0.0000000000000000    3.4849271965228366   -0.0000000000000000
    -0.0000000000000000   -0.0000000000000000    8.4281431352710658
 H   O  
   8   8
Selective dynamics
Cartesian
  2.7399803210251532  1.4472529498785058 -0.7065383476443403   T   T   T
  0.7449468754976825  2.0376742466443325  3.5075332199911924   T   T   T
  0.2952106483829119  0.9975167227637368  1.4004974361734230   T   T   T
  3.1897165481399194  2.4874104737590996  5.6145690038089509   T   T   T
  2.4874104737590970  3.1897165481399203  2.8135741314621026   T   T   T
  0.9975167227637353  0.2952106483829121  7.0276456990976346   T   T   T
  1.4472529498785054  2.7399803210251532  9.1346814829153935   T   T   T
  2.0376742466443312  0.7449468754976820  4.9206099152798677   T   T   T
  0.5806436682107058  0.4509194721554453  2.1554460474296571   T   T   T
  2.9042835283121313  3.0340077243673846  6.3695176150651891   T   T   T
  1.2915441261059697  2.3231072664721251  4.2624818312474240   T   T   T
  2.1933830704168611  1.1618199300507108  0.0484102636118917   T   T   T
  1.1618199300507124  2.1933830704168646  8.3797328716591721   T   T   T
  2.3231072664721211  1.2915441261059697  4.1656613040236348   T   T   T
  0.4509194721554453  0.5806436682107061  6.2726970878413937   T   T   T
  3.0340077243673895  2.9042835283121295  2.0586255202058723   T   T   T