sim/src/tests/singlebond_stretch/test_HO_PH2.xyzcmp


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HO_PH2.mmp
O 1.109000 -0.139000 0.000000
P -0.565000 0.102000 0.000000
H 1.561000 0.714000 0.000000
H -0.897000 -0.825000 -1.033000
H -0.897000 -0.825000 1.033000