1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
|
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) (7.106569) (-2.115855, 7.141500, -3.627500) (1.000000)
egroup (View Data)
group (l_cysteine_mm2_neutral)
info opengroup open = True
mol (l_cysteine_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) (3911, -6296, 2679) def
bond1 2
atom 10 (1) (4624, -7041, 2328) def
bond1 9
atom 11 (16) (4764, -5341, 4019) def
bond1 9
atom 12 (1) (5934, -5139, 3376) def
bond1 11
atom 13 (1) (3714, -5584, 1879) def
bond1 9
info chunk hotspot = 8
egroup (l_cysteine_mm2_neutral)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part l_cysteine_mm2_neutral
|
