1     6  uAMOEBA Water Dimer
2     1  O      1.428385    0.000000   -0.067870     1     2     3
3     2  H      0.507572    0.000000    0.165396     2     1
4     3  H      1.905702    0.000000    0.753395     2     1
5     4  O     -1.373554    0.000000    0.065407     1     5     6
6     5  H     -1.641670    0.758372   -0.439860     2     4
7     6  H     -1.641670   -0.758372   -0.439860     2     4
8