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path: root/sim/src/tests/heteroatom_organics/test_C3H6PH.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) (6.160304) (-0.016000, 0.179000, 0.148500) (1.000000)
egroup (View Data)
group (C3H6PH)
info opengroup open = True
mol (C3H6PH.pdb) def
atom 1 (15) (159, 1495, -27) def
atom 2 (6) (639, 98, -1298) def
bond1 1
atom 3 (6) (-531, -69, 704) def
bond1 1
atom 4 (6) (-367, -1278, -331) def
bond1 2 3
atom 5 (1) (-1453, 1748, -947) def
bond1 1
atom 6 (1) (1445, -570, -1419) def
bond1 2
atom 7 (1) (34, 299, -1995) def
bond1 2
atom 8 (1) (834, -95, 1720) def
bond1 3
atom 9 (1) (-579, 145, 2187) def
bond1 3
atom 10 (1) (-1411, -855, -558) def
bond1 4
atom 11 (1) (-148, -2072, 392) def
bond1 4
egroup (C3H6PH)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C3H6PH