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
|
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) (0.699515, -0.164707, -0.613943, 0.326535) (2.315082) (0.005000, 0.002500, -0.004000) (1.000000)
egroup (View Data)
group (CH3OCH3)
info opengroup open = True
mol (CH3OCH3.pdb) def
atom 1 (8) (769, 819, -3) def
atom 2 (6) (421, 186, 1208) def
bond1 1
atom 3 (6) (-10, 365, -1088) def
bond1 1
atom 4 (1) (561, -906, 1157) def
bond1 2
atom 5 (1) (-627, 383, 1490) def
bond1 2
atom 6 (1) (1073, 589, 1987) def
bond1 2
atom 7 (1) (-1083, 569, -934) def
bond1 3
atom 8 (1) (110, -718, -1256) def
bond1 3
atom 9 (1) (326, 901, -1979) def
bond1 3
egroup (CH3OCH3)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part CH3OCH3
|
