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path: root/sim/src/tests/heteroatom_organics/C3H6BH.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) (1.000000, 0.000000, 0.000000, 0.000000) (6.019343) (0.005500, -0.013500, -0.001000) (1.000000)
egroup (View Data)
group (C3H6BH)
info opengroup open = True
mol (C3H6BH.pdb) def
atom 1 (5) (324, 897, -40) def
atom 2 (6) (67, -217, -1138) def
bond1 1
atom 3 (6) (171, -155, 1133) def
bond1 1
atom 4 (6) (-84, -1244, 35) def
bond1 2 3
atom 5 (1) (545, 2072, -83) def
bond1 1
atom 6 (1) (903, -410, -1823) def
bond1 2
atom 7 (1) (-823, -83, -1767) def
bond1 2
atom 8 (1) (1060, -315, 1757) def
bond1 3
atom 9 (1) (-664, 19, 1825) def
bond1 3
atom 10 (1) (-1071, -1713, 94) def
bond1 4
atom 11 (1) (663, -2045, 23) def
bond1 4
egroup (C3H6BH)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C3H6BH