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
|
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) (6.373432) (-0.004000, -0.137500, -0.033000) (1.000000)
egroup (View Data)
group (C3H6AlH)
info opengroup open = True
mol (C3H6AlH.pdb) def
atom 1 (13) (560, 1408, -24) def
atom 2 (6) (57, -333, -1083) def
bond1 1
atom 3 (6) (427, -576, 1259) def
bond1 1
atom 4 (6) (-309, -1066, -204) def
bond1 2 3
atom 5 (1) (895, 2510, 5) def
bond1 1
atom 6 (1) (590, -1394, -2337) def
bond1 2
atom 7 (1) (-980, -122, -2325) def
bond1 2
atom 8 (1) (1493, -1104, 1461) def
bond1 3
atom 9 (1) (-355, 245, 2691) def
bond1 3
atom 10 (1) (-1251, -1906, 591) def
bond1 4
atom 11 (1) (634, -2354, 228) def
bond1 4
egroup (C3H6AlH)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C3H6AlH
|
