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path: root/sim/src/tests/heteroatom_organics/CH3BHCH3.mmp
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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) (0.773200, -0.146735, -0.527464, 0.320018) (2.850967) (0.007500, -0.024500, 0.016000) (1.000000)
egroup (View Data)
group (CH3BHCH3)
info opengroup open = True
mol (CH3BHCH3.pdb) def
atom 1 (5) (341, 284, -27) def
atom 2 (6) (-20, -221, 1414) def
bond1 1
atom 3 (6) (-334, -234, -1345) def
bond1 1
atom 4 (1) (1198, 1122, -125) def
bond1 1
atom 5 (1) (-706, -1073, 1454) def
bond1 2
atom 6 (1) (-494, 618, 1950) def
bond1 2
atom 7 (1) (878, -452, 2001) def
bond1 2
atom 8 (1) (-1213, -871, -1199) def
bond1 3
atom 9 (1) (421, -831, -1884) def
bond1 3
atom 10 (1) (-587, 582, -2033) def
bond1 3
egroup (CH3BHCH3)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part CH3BHCH3