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path: root/sim/src/tests/heteroatom_organics/test_B_ADAM_C3v.xyzcmp
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B_ADAM_C3v.mmp
C -0.771000 1.336000 0.518000
C -0.771000 -1.336000 0.518000
C 1.543000 0.000000 0.518000
B 0.000000 0.000000 0.817000
C -0.736000 1.274000 -1.062000
C -0.736000 -1.274000 -1.062000
C 1.471000 0.000000 -1.062000
C 0.729000 -1.262000 -1.554000
C 0.729000 1.262000 -1.554000
C -1.457000 0.000000 -1.554000
H -0.275000 2.256000 0.848000
H -1.817000 -1.366000 0.848000
H 2.091000 0.890000 0.848000
H -1.817000 1.366000 0.848000
H -0.275000 -2.256000 0.848000
H 2.091000 -0.890000 0.848000
H -1.247000 2.160000 -1.462000
H -1.247000 -2.160000 -1.462000
H 2.494000 0.000000 -1.462000
H 0.749000 -1.297000 -2.653000
H 0.749000 1.297000 -2.653000
H -1.497000 0.000000 -2.653000
H 1.249000 -2.163000 -1.202000
H 1.249000 2.163000 -1.202000
H -2.497000 0.000000 -1.202000