File: chiral2a.mol

package info (click to toggle)
rdkit 202209.3-1
  • links: PTS, VCS
  • area: main
  • in suites: bookworm
  • size: 203,880 kB
  • sloc: cpp: 334,239; python: 80,247; ansic: 24,579; java: 7,667; sql: 2,123; yacc: 1,884; javascript: 1,358; lex: 1,260; makefile: 576; xml: 229; fortran: 183; cs: 181; sh: 101
file content (14 lines) | stat: -rw-r--r-- 523 bytes parent folder | download | duplicates (8)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
chiral2.mol
  ChemDraw04200416412D

  5  4  0  0  0  0  0  0  0  0999 V2000
   -0.0141    0.0553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8109    0.0553    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4266    0.7697    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0141   -0.7697    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8109   -0.1583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  1      
  1  3  1  0      
  1  4  1  0      
  1  5  1  0      
M  END