mmpformat 080327 required; 080529 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) (9.547311) (0.000000, 0.000000, 0.000000) (1.000000) csys (HomeView1) (1.000000, 0.000000, 0.000000, 0.000000) (10.000000) (0.000000, 0.000000, 0.000000) (1.000000) csys (LastView1) (0.965474, 0.127192, -0.200452, 0.107242) (9.547311) (0.000000, 0.000000, 0.000000) (1.000000) egroup (View Data) group (CYX_CYSTEINE-S-S-CYSTEINE) info opengroup open = True mol (Chunk1) def atom 1 (7) (-4876, -1615, 96) def info atom atomtype = sp2(graphitic) atom 2 (1) (-5409, -1336, 916) def bond1 1 atom 3 (1) (-5219, -2365, -499) def bond1 1 atom 4 (6) (-3581, -916, -239) def bond1 1 atom 5 (1) (-3230, -355, 627) def bond1 4 atom 6 (6) (-3764, 126, -1384) def info atom atomtype = sp2 bond1 4 atom 7 (8) (-4219, -177, -2467) def info atom atomtype = sp2 bond2 6 atom 8 (8) (-3364, 1502, -1113) def bond1 6 atom 9 (1) (-4106, 1974, -713) def bond1 8 atom 10 (6) (-2441, -1920, -606) def bond1 4 atom 11 (1) (-2312, -2671, 171) def bond1 10 atom 12 (1) (-2649, -2424, -1548) def bond1 10 atom 13 (7) (3919, -2625, -2687) def info atom atomtype = sp2(graphitic) atom 14 (1) (4421, -2422, -3548) def bond1 13 atom 15 (1) (4241, -3372, -2078) def bond1 13 atom 16 (6) (2696, -1820, -2316) def bond1 13 atom 17 (1) (2468, -1119, -3118) def bond1 16 atom 18 (6) (2933, -947, -1048) def info atom atomtype = sp2 bond1 16 atom 19 (8) (3491, -1377, -62) def info atom atomtype = sp2 bond2 18 atom 20 (8) (2452, 430, -1080) def bond1 18 atom 21 (1) (3151, 1002, -1422) def bond1 20 atom 22 (6) (1430, -2722, -2113) def bond1 16 atom 23 (1) (1491, -3623, -2720) def bond1 22 atom 24 (1) (1302, -3020, -1074) def bond1 22 atom 25 (16) (-793, -1064, -753) def bond1 10 atom 26 (16) (-135, -1875, -2658) def bond1 25 22 egroup (CYX_CYSTEINE-S-S-CYSTEINE) end1 group (Clipboard) info opengroup open = False group (Clipboard item 1) info opengroup open = True mol (Chunk1) def atom 27 (7) (-5956, -1311, 53) def info atom atomtype = sp2(graphitic) atom 28 (1) (-6647, -648, 393) def bond1 27 atom 29 (1) (-6234, -2264, -166) def bond1 27 atom 30 (6) (-4521, -878, -132) def bond1 27 atom 31 (1) (-4223, -240, 701) def bond1 30 atom 32 (6) (-4335, -23, -1421) def info atom atomtype = sp2 bond1 30 atom 33 (8) (-4820, -345, -2485) def info atom atomtype = sp2 bond2 32 atom 34 (8) (-3544, 1199, -1313) def bond1 32 atom 35 (1) (-4100, 1908, -964) def bond1 34 atom 36 (6) (-3527, -2085, -141) def bond1 30 atom 37 (1) (-3647, -2708, 744) def bond1 36 atom 38 (1) (-3647, -2700, -1031) def bond1 36 mol (CYM_CYSTEINE_with_negative_charge.in_frag) def atom 39 (16) (-1759, -1529, -132) def info atom atomtype = sp2 bond1 36 egroup (Clipboard item 1) egroup (Clipboard) end molecular machine part CYX_CYSTEINE-S-S-CYSTEINE