summaryrefslogtreecommitdiff
path: root/sim/src/tests/floppy_organics/test_C6H14c.mmp
blob: f1455d8baacdbad3571a63cc41f56067acc056ab (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
56
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) (7.032981) (-0.000000, -0.000000, -0.000000) (1.000000)
egroup (View Data)
group (C6H14c)
info opengroup open = True
mol (C6H14c.pdb) cpk
atom 1 (6) (-292, -311, 495) def
atom 2 (6) (-181, 1044, -85) def
bond1 1
atom 3 (6) (1319, 1496, 644) def
bond1 2
atom 4 (6) (-355, -1341, 1333) def
bond1 1
atom 5 (6) (-493, -1368, -904) def
bond1 1
atom 6 (6) (-1636, 1509, 61) def
bond1 2
atom 7 (1) (1130, -1030, -361) def
bond1 1
atom 8 (1) (37, 824, -1400) def
bond1 2
atom 9 (1) (1180, 2346, 842) def
bond1 3
atom 10 (1) (1179, 1689, 1494) def
bond1 3
atom 11 (1) (2000, 873, 219) def
bond1 3
atom 12 (1) (112, -2298, 1691) def
bond1 4
atom 13 (1) (-1523, -932, 1551) def
bond1 4
atom 14 (1) (-129, -758, 2084) def
bond1 4
atom 15 (1) (-515, -2120, -986) def
bond1 5
atom 16 (1) (-768, -1186, -2114) def
bond1 5
atom 17 (1) (-2005, -1543, -1267) def
bond1 5
atom 18 (1) (-1141, 1470, 1319) def
bond1 6
atom 19 (1) (-1430, 2233, -388) def
bond1 6
atom 20 (1) (-2321, 1120, 250) def
bond1 6
egroup (C6H14c)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C6H14c