File: three_coordinate_chirality.1.mol

package info (click to toggle)
rdkit 201809.1%2Bdfsg-6
  • links: PTS, VCS
  • area: main
  • in suites: buster
  • size: 123,688 kB
  • sloc: cpp: 230,509; python: 70,501; java: 6,329; ansic: 5,427; sql: 1,899; yacc: 1,739; lex: 1,243; makefile: 445; xml: 229; fortran: 183; sh: 123; cs: 93
file content (12 lines) | stat: -rw-r--r-- 428 bytes parent folder | download | duplicates (8)
1
2
3
4
5
6
7
8
9
10
11
12

  Mrv0540 07221113152D          

  4  3  0  0  0  0            999 V2000
   -0.2121    0.4950    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6129    0.4950    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6129    1.3200    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.1962   -0.0884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  1  0  0  0
M  END