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path: root/sim/src/tests/heteroatom_organics/test_CH3OH.mmp
blob: 841b2fc8271d0ce5cf46d96eb715147eed0fa94f (plain)
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mmpformat 050502 required; 050706 preferred
kelvin 300
group (View Data)
info opengroup open = True
csys (HomeView) (1.000000, 0.000000, 0.000000, 0.000000) (10.000000) (0.000000, 0.000000, 0.000000) (1.000000)
csys (LastView) (0.891717, 0.122415, 0.201627, 0.386267) (2.102428) (-0.130000, -0.032000, -0.000000) (1.000000)
egroup (View Data)
group (CH3OH)
info opengroup open = True
mol (CH3OH.pdb) def
atom 1 (8) (-742, 165, -43) def
atom 2 (6) (633, -647, 212) def
bond1 1
atom 3 (1) (-459, 1844, 41) def
bond1 1
atom 4 (1) (236, -1657, 119) def
bond1 2
atom 5 (1) (1079, -215, 728) def
bond1 2
atom 6 (1) (890, -159, -1027) def
bond1 2
egroup (CH3OH)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part CH3OH