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path: root/sim/src/tests/singlebond_stretch/test_H_NH2.xyzcmp
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H_NH2.mmp
N 0.024000 -0.059000 0.000000
H -0.991000 -0.088000 0.000000
H 0.326000 0.455000 -0.823000
H 0.326000 0.455000 0.823000