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
|
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) (6.925915) (-0.012000, -0.003000, -0.008000) (1.000000)
egroup (View Data)
group (C5H10PH)
info opengroup open = True
mol (C5H10PH.pdb) def
atom 1 (15) (-335, 1618, 236) def
atom 2 (6) (456, 349, 1379) def
bond1 1
atom 3 (6) (123, 775, -1384) def
bond1 1
atom 4 (6) (-425, -662, -1419) def
bond1 3
atom 5 (6) (-128, -1048, 1108) def
bond1 2
atom 6 (6) (162, -1558, -314) def
bond1 4 5
atom 7 (1) (717, 2582, 255) def
bond1 1
atom 8 (1) (262, 651, 2414) def
bond1 2
atom 9 (1) (1544, 330, 1241) def
bond1 2
atom 10 (1) (-294, 1363, -2209) def
bond1 3
atom 11 (1) (1213, 762, -1509) def
bond1 3
atom 12 (1) (-208, -1106, -2398) def
bond1 4
atom 13 (1) (-1520, -642, -1323) def
bond1 4
atom 14 (1) (279, -1756, 1843) def
bond1 5
atom 15 (1) (-1215, -1033, 1267) def
bond1 5
atom 16 (1) (-232, -2576, -423) def
bond1 6
atom 17 (1) (1251, -1631, -453) def
bond1 6
egroup (C5H10PH)
end1
group (Clipboard)
info opengroup open = False
egroup (Clipboard)
end molecular machine part C5H10PH
|
