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) (0.710471, -0.393812, -0.499919, -0.300374) (3.364549) (-24.320500, -6.915000, 20.769500) (1.000000)
egroup (View Data)
group (amphetamine)
info opengroup open = True
mol (amphetamine.pdb) def
atom 1 (6) (26851, 6922, -21801) def
info atom atomtype = sp2
atom 2 (6) (25525, 6514, -21959) def
info atom atomtype = sp2
bonda 1
atom 3 (6) (24604, 6715, -20928) def
info atom atomtype = sp2
bonda 2
atom 4 (6) (25010, 7323, -19738) def
info atom atomtype = sp2
bonda 3
atom 5 (6) (26336, 7731, -19580) def
info atom atomtype = sp2
bonda 4
atom 6 (6) (27257, 7530, -20611) def
info atom atomtype = sp2
bonda 5 1
atom 7 (1) (27569, 6765, -22605) def
bond1 1
atom 8 (1) (25208, 6039, -22888) def
bond1 2
atom 9 (6) (23142, 6265, -21103) def
bond1 3
atom 10 (1) (24292, 7480, -18934) def
bond1 4
atom 11 (1) (26653, 8206, -18651) def
bond1 5
atom 12 (1) (28292, 7849, -20487) def
bond1 6
atom 13 (6) (22345, 6601, -19829) def
bond1 9
atom 14 (6) (22389, 8119, -19581) def
bond1 13
atom 15 (7) (20902, 6157, -20001) def
bond1 13
atom 16 (1) (23111, 5190, -21278) def
bond1 9
atom 17 (1) (22701, 6784, -21954) def
bond1 9
atom 18 (1) (22786, 6082, -18978) def
bond1 13
atom 19 (1) (23424, 8439, -19458) def
bond1 14
atom 20 (1) (21949, 8640, -20432) def
bond1 14
atom 21 (1) (21826, 8358, -18679) def
bond1 14
atom 22 (1) (20470, 6667, -20837) def
bond1 15
atom 23 (1) (20349, 6390, -19116) def
bond1 15
egroup (amphetamine)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part amphetamine