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) (0.360809, -0.007225, 0.222518, -0.905677) (4.870842) (-0.190000, -0.911000, 0.297500) (1.000000)
egroup (View Data)
group (biotin)
info opengroup open = True
mol (biotin) def
atom 1 (16) (1075, -1646, 2408) def
atom 2 (6) (921, -2017, -1917) def
info atom atomtype = sp2
atom 3 (7) (2097, -1972, -1290) def
bond1 2
atom 4 (6) (1906, -2589, 42) def
bond1 3
atom 5 (6) (369, -2655, 163) def
bond1 4
atom 6 (7) (-27, -2674, -1251) def
bond1 2 5
atom 7 (8) (730, -1497, -3003) def
info atom atomtype = sp2
bond2 2
atom 8 (1) (2440, -951, -1231) def
bond1 3
atom 9 (1) (2917, -876, 1054) def
atom 10 (1) (2315, -3611, -38) def
bond1 4
atom 11 (6) (2492, -1863, 1286) def
bond1 1 4 9
atom 12 (6) (-130, -1478, 1053) def
bond1 1 5
atom 13 (1) (61, -3608, 630) def
bond1 5
atom 14 (1) (-1010, -2264, -1408) def
bond1 6
atom 15 (6) (-43, 3, 561) def
bond1 12
atom 16 (1) (3262, -2465, 1793) def
bond1 11
atom 17 (1) (-1145, -1679, 1431) def
bond1 12
atom 18 (1) (948, 247, 157) def
bond1 15
atom 19 (1) (-182, 610, 1468) def
bond1 15
atom 20 (6) (-1130, 442, -461) def
bond1 15
atom 21 (1) (-903, -4, -1439) def
bond1 20
atom 22 (6) (-1180, 1981, -700) def
bond1 20
atom 23 (1) (-2122, 89, -137) def
bond1 20
atom 24 (1) (-173, 2351, -957) def
bond1 22
atom 25 (6) (-1739, 2794, 500) def
bond1 22
atom 26 (1) (-1839, 2167, -1566) def
bond1 22
atom 27 (1) (-1063, 2747, 1366) def
bond1 25
atom 28 (1) (-2719, 2393, 803) def
bond1 25
atom 29 (6) (-1914, 4242, 116) def
info atom atomtype = sp2
bond1 25
atom 30 (8) (-1238, 5137, 596) def
info atom atomtype = sp2
bond2 29
atom 31 (8) (-2856, 4499, -789) def
bond1 29
atom 32 (1) (-2882, 5433, -960) def
bond1 31
egroup (biotin)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part biotin