File: small2.mol

package info (click to toggle)
rdkit 202503.1-5
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid
  • size: 220,160 kB
  • sloc: cpp: 399,240; python: 77,453; ansic: 25,517; java: 8,173; javascript: 4,005; sql: 2,389; yacc: 1,565; lex: 1,263; cs: 1,081; makefile: 580; xml: 229; fortran: 183; sh: 105
file content (22 lines) | stat: -rw-r--r-- 674 bytes parent folder | download | duplicates (15) 
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
 
small.mol


  9  8  0  0  0                 1 V2000
    0.5496   -0.7809    0.0905 C   0  0  0  0  0
   -0.5630   -0.0400    0.1219 C   0  0  0  0  0
   -0.5217    1.4556    0.0773 C   0  0  0  0  0
    0.4757   -1.8781    0.1158 H   0  0  0  0  0
    1.5378   -0.3016    0.0300 H   0  0  0  0  0
   -1.5378   -0.5448    0.1918 H   0  0  0  0  0
   -0.9145    1.8185   -0.8983 H   0  0  0  0  0
    0.5256    1.8113    0.2016 H   0  0  0  0  0
   -1.1436    1.8781    0.8983 H   0  0  0  0  0
  1  2  2  0  0  0
  1  4  1  0  0  0
  1  5  1  0  0  0
  2  3  1  0  0  0
  2  6  1  0  0  0
  3  7  1  0  0  0
  3  8  1  0  0  0
  3  9  1  0  0  0
M  END