summaryrefslogtreecommitdiff
path: root/sim/src/tests/floppy_organics/C6H14b.mmp
blob: 63bb3149db2af94a2dc63d62684f5ba46d58f237 (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
44
45
46
47
48
49
50
51
52
53
54
55
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) (6.839715) (-0.000000, -0.000000, -0.000000) (1.000000)
egroup (View Data)
group (C6H14b)
info opengroup open = True
mol (C6H14b.pdb) cpk
atom 1 (6) (40, -776, 0) def
atom 2 (6) (-41, 776, 0) def
bond1 1
atom 3 (6) (-785, 1328, -1227) def
bond1 2
atom 4 (6) (705, -1328, -1274) def
bond1 1
atom 5 (6) (785, -1328, 1227) def
bond1 1
atom 6 (6) (-705, 1328, 1274) def
bond1 2
atom 7 (1) (-994, -1153, 35) def
bond1 1
atom 8 (1) (993, 1153, -35) def
bond1 2
atom 9 (1) (-837, 2422, -1185) def
bond1 3
atom 10 (1) (-303, 1065, -2173) def
bond1 3
atom 11 (1) (-1815, 951, -1264) def
bond1 3
atom 12 (1) (758, -2422, -1238) def
bond1 4
atom 13 (1) (1731, -953, -1374) def
bond1 4
atom 14 (1) (162, -1062, -2186) def
bond1 4
atom 15 (1) (837, -2422, 1185) def
bond1 5
atom 16 (1) (303, -1064, 2173) def
bond1 5
atom 17 (1) (1815, -951, 1263) def
bond1 5
atom 18 (1) (-758, 2422, 1237) def
bond1 6
atom 19 (1) (-1732, 953, 1374) def
bond1 6
atom 20 (1) (-163, 1062, 2186) def
bond1 6
egroup (C6H14b)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C6H14b