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) (6.404898) (0.355500, -0.642000, 3.493000) (1.000000) egroup (View Data) group (butane) info opengroup open = True mol (butane) def atom 1 (6) (-99, 279, -1607) def atom 2 (1) (991, 279, -1607) def bond1 1 atom 3 (1) (-463, -749, -1607) def bond1 1 atom 4 (1) (-463, 793, -717) def bond1 1 atom 5 (6) (-613, 1004, -2865) def bond1 1 atom 6 (6) (-99, 279, -4122) def bond1 5 atom 7 (1) (-1702, 1004, -2865) def bond1 5 atom 8 (1) (-249, 2033, -2865) def bond1 5 atom 9 (1) (-463, -749, -4122) def bond1 6 atom 10 (1) (991, 279, -4122) def bond1 6 atom 11 (6) (-613, 1004, -5379) def bond1 6 atom 12 (1) (-1702, 1004, -5379) def bond1 11 atom 13 (1) (-249, 2033, -5379) def bond1 11 atom 14 (1) (-249, 491, -6269) def bond1 11 egroup (butane) end1 group (Clipboard) info opengroup open = False egroup (Clipboard) end molecular machine part butane