1 6 iAMOEBA Water Dimer
2 1 O 1.450775 0.000000 0.068786 1 2 3
3 2 H 0.500782 0.000000 -0.133639 2 1
4 3 H 1.891324 0.000000 -0.781339 2 1
5 4 O -1.382513 0.000000 -0.061325 1 5 6
6 5 H -1.737647 -0.765097 0.398288 2 4
7 6 H -1.737647 0.765097 0.398288 2 4
8