mmpformat 050920 required; 070415 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) (0.834588, -0.085788, 0.195024, 0.508005) (5.264676) (-2.115855, 7.141500, -3.627500) (1.000000) egroup (View Data) group (l_isoleucine_mm2_neutral) info opengroup open = True mol (l_isoleucine_mm2_neutral) def atom 1 (7) (1637, -5998, 3746) def atom 2 (6) (2595, -6954, 3200) def bond1 1 atom 3 (6) (2907, -8016, 4233) def info atom atomtype = sp2 bond1 2 atom 4 (8) (2790, -9184, 3975) def info atom atomtype = sp2 bond2 3 atom 5 (1) (1972, -5099, 4066) def bond1 1 atom 6 (1) (2123, -7452, 2318) def bond1 2 atom 7 (0) (984, -6223, 3983) def bond1 1 atom 8 (0) (3100, -7764, 4937) def bond1 3 atom 9 (6) (3902, -6292, 2705) def bond1 2 atom 10 (6) (4589, -5564, 3885) def bond1 9 atom 11 (1) (5557, -6011, 4069) def bond1 10 atom 12 (1) (3976, -5655, 4771) def bond1 10 atom 13 (6) (4769, -4069, 3533) def bond1 10 atom 14 (1) (5383, -3978, 2647) def bond1 13 atom 15 (1) (5250, -3560, 4358) def bond1 13 atom 16 (1) (3801, -3623, 3349) def bond1 13 atom 17 (1) (4566, -7052, 2315) def bond1 9 atom 18 (6) (3574, -5271, 1591) def bond1 9 atom 19 (1) (3093, -5780, 766) def bond1 18 atom 20 (1) (4489, -4809, 1245) def bond1 18 atom 21 (1) (2911, -4511, 1982) def bond1 18 info chunk hotspot = 8 egroup (l_isoleucine_mm2_neutral) end1 group (Clipboard) info opengroup open = False egroup (Clipboard) end molecular machine part l_isoleucine_mm2_neutral