File: hao_xu_6.mol

package info (click to toggle)
openbabel 2.4.1%2Bdfsg-3
  • links: PTS, VCS
  • area: main
  • in suites: buster
  • size: 58,308 kB
  • sloc: cpp: 459,210; ansic: 90,514; php: 13,963; python: 7,899; perl: 6,518; pascal: 793; sh: 179; xml: 97; ruby: 64; makefile: 46; java: 23; cs: 14
file content (30 lines) | stat: -rw-r--r-- 847 bytes parent folder | download | duplicates (8) 
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
 

 OpenBabel11010922452D

 10 15  0  0  0  0  0  0  0  0999 V2000
  -11.0500   -2.7250    0.0000 C   0  0  0  0  0
  -10.1840   -3.2250    0.0000 C   0  0  0  0  0
  -10.1840   -4.2250    0.0000 C   0  0  0  0  0
  -11.0500   -4.7250    0.0000 C   0  0  0  0  0
  -11.9160   -4.2250    0.0000 C   0  0  0  0  0
  -11.9160   -3.2250    0.0000 C   0  0  0  0  0
  -11.2607   -4.1852    0.0000 C   0  0  0  0  0
  -11.2563   -3.3543    0.0000 C   0  0  0  0  0
  -10.5801   -3.7079    0.0000 C   0  0  0  0  0
  -11.0618   -3.7079    0.0000 C   0  0  0  0  0
  1  2  1  0  0  0
  6  1  1  0  0  0
  8  1  1  0  0  0
  2  3  1  0  0  0
  2  9  1  0  0  0
  3  4  1  0  0  0
  9  3  1  0  0  0
  4  5  1  0  0  0
  7  4  1  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  6  8  1  0  0  0
  7 10  1  0  0  0
  8 10  1  0  0  0
 10  9  1  0  0  0
M  END