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
|
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) (6.157707) (-0.000000, -0.000000, -0.000000) (1.000000)
egroup (View Data)
group (C4H8)
info opengroup open = True
mol (C4H8.pdb) def
atom 1 (6) (-417, 1325, -312) def
atom 2 (6) (344, 443, 1363) def
bond1 1
atom 3 (6) (-31, -94, -404) def
bond1 1
atom 4 (6) (-308, -1102, -251) def
bond1 2 3
atom 5 (1) (1073, 1739, -63) def
bond1 1
atom 6 (1) (-652, 1696, -121) def
bond1 1
atom 7 (1) (-1130, 145, 2088) def
bond1 2
atom 8 (1) (756, 874, 1687) def
bond1 2
atom 9 (1) (-29, -303, -1721) def
bond1 3
atom 10 (1) (-1325, -295, -1423) def
bond1 3
atom 11 (1) (-241, -1742, 107) def
bond1 4
atom 12 (1) (1792, -829, -147) def
bond1 4
egroup (C4H8)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C4H8
|