File: complex2D_5a.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 (23 lines) | stat: -rw-r--r-- 721 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
 

 OpenBabel04190901382D          

  9  9  0  0  0  0            999 V2000
   -2.7107    1.4438    0.0000 C   0  0  0  0  0
   -3.4252    1.0313    0.0000 C   0  0  0  0  0
   -3.4252    0.2062    0.0000 C   0  0  0  0  0
   -2.7107   -0.2063    0.0000 C   0  0  0  0  0
   -1.9962    0.2062    0.0000 C   0  0  0  0  0
   -1.9962    1.0313    0.0000 C   0  0  2  0  0
   -1.2818    1.4438    0.0000 C   0  0  0  0  0
   -1.2818    2.2688    0.0000 O   0  0  0  0  0
   -0.5673    1.0312    0.0000 C   0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  1  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
M  END