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
45
46
47
48
|
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) (6.492590) (-0.005000, 0.126500, 0.009500) (1.000000)
egroup (View Data)
group (C5H10O)
info opengroup open = True
mol (C5H10O.pdb) def
atom 1 (8) (-344, 1733, 332) def
atom 2 (6) (52, 1209, 1317) def
bond1 1
atom 3 (6) (614, 1501, -1230) def
bond1 1
atom 4 (6) (-854, 32, -1300) def
bond1 3
atom 5 (6) (-154, -940, 1196) def
bond1 2
atom 6 (6) (-270, -1201, -64) def
bond1 4 5
atom 7 (1) (74, 1832, 2265) def
bond1 2
atom 8 (1) (1308, 483, 1240) def
bond1 2
atom 9 (1) (-320, 1623, -1701) def
bond1 3
atom 10 (1) (1261, 1177, -1326) def
bond1 3
atom 11 (1) (18, -604, -2785) def
bond1 4
atom 12 (1) (-1606, 221, -1255) def
bond1 4
atom 13 (1) (517, -657, 1728) def
bond1 5
atom 14 (1) (-1216, -608, 908) def
bond1 5
atom 15 (1) (312, -1490, -306) def
bond1 6
atom 16 (1) (1287, -1650, -504) def
bond1 6
egroup (C5H10O)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C5H10O
|
