summaryrefslogtreecommitdiff
path: root/sim/src/tests/floppy_organics/C4H10c.mmp
blob: be02d9b1215d58129176b8bac115fbfdcd6fe478 (plain)
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
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) (6.326870) (-0.000000, -0.000000, -0.000000) (1.000000)
egroup (View Data)
group (C4H10c)
info opengroup open = True
mol (C4H10c.pdb) def
atom 1 (6) (741, 1312, -109) def
atom 2 (6) (87, -19, 291) def
bond1 1
atom 3 (6) (-1330, -130, -290) def
bond1 2
atom 4 (6) (958, -1211, -131) def
bond1 2
atom 5 (1) (133, 2164, 214) def
bond1 1
atom 6 (1) (850, 1375, -1200) def
bond1 1
atom 7 (1) (1738, 1422, 333) def
bond1 1
atom 8 (1) (4, -36, 1388) def
bond1 2
atom 9 (1) (-1815, -1062, 20) def
bond1 3
atom 10 (1) (-1962, 702, 36) def
bond1 3
atom 11 (1) (-1310, -119, -1388) def
bond1 3
atom 12 (1) (520, -2164, 187) def
bond1 4
atom 13 (1) (1962, -1140, 300) def
bond1 4
atom 14 (1) (1065, -1242, -1223) def
bond1 4
egroup (C4H10c)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C4H10c