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
49
50
|
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) (6.601761) (-0.024000, -0.009000, 0.002000) (1.000000)
egroup (View Data)
group (C5H10NH)
info opengroup open = True
mol (C5H10NH.pdb) def
atom 1 (7) (-261, 1312, 418) def
atom 2 (6) (116, 1001, 1360) def
bond1 1
atom 3 (6) (721, 903, -1141) def
bond1 1
atom 4 (6) (-741, -366, -1520) def
bond1 3
atom 5 (6) (-359, -607, 589) def
bond1 2
atom 6 (6) (327, -1151, -32) def
bond1 4 5
atom 7 (1) (-1, 2619, 239) def
bond1 1
atom 8 (1) (-500, 1331, 1850) def
bond1 2
atom 9 (1) (1632, 809, 2169) def
bond1 2
atom 10 (1) (117, 1581, -2170) def
bond1 3
atom 11 (1) (1192, -158, -828) def
bond1 3
atom 12 (1) (-8, -1222, -1972) def
bond1 4
atom 13 (1) (-1782, -542, -1749) def
bond1 4
atom 14 (1) (6, -1000, 2588) def
bond1 5
atom 15 (1) (-1179, -540, 1094) def
bond1 5
atom 16 (1) (6, -2328, 90) def
bond1 6
atom 17 (1) (1629, -1381, 131) def
bond1 6
egroup (C5H10NH)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C5H10NH
|
