sim/src/tests/singlebond_stretch/test_H2N_NH2.xyzcmp


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H2N_NH2.mmp
N 0.735000 -0.101000 0.000000
N -0.735000 0.101000 0.000000
H 1.064000 0.439000 0.801000
H -1.064000 -0.439000 -0.801000
H 1.064000 0.439000 -0.801000
H -1.064000 -0.439000 0.801000