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path: root/sim/src/tests/heteroatom_organics/test_ADAM_AlH2_Cs.xyzcmp
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ADAM_AlH2_Cs.mmp
C 0.656000 -0.028000 0.000000
C 0.031000 -0.686000 -1.261000
C 0.031000 -0.686000 1.261000
C 0.262000 1.486000 0.000000
Al 2.639000 -0.153000 0.000000
C -1.275000 1.649000 0.000000
C -1.506000 -0.524000 -1.261000
C -1.506000 -0.524000 1.261000
C -2.094000 -1.190000 0.000000
C -1.862000 0.979000 -1.259000
C -1.862000 0.979000 1.259000
H 0.443000 -0.237000 -2.176000
H 0.443000 -0.237000 2.176000
H 0.285000 -1.756000 -1.303000
H 0.285000 -1.756000 1.303000
H 0.678000 1.991000 -0.885000
H 0.678000 1.991000 0.885000
H 3.454000 -0.179000 -1.371000
H 3.454000 -0.179000 1.371000
H -1.530000 2.719000 0.000000
H -1.924000 -0.998000 -2.159000
H -1.924000 -0.998000 2.159000
H -3.189000 -1.099000 0.000000
H -1.864000 -2.265000 0.000000
H -2.953000 1.105000 -1.284000
H -2.953000 1.105000 1.284000
H -1.467000 1.460000 -2.165000
H -1.467000 1.460000 2.165000