File: stereo3d_trans.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 (16 lines) | stat: -rw-r--r-- 564 bytes parent folder | download | duplicates (5)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
F/C=C/F
     RDKit          3D

  6  5  0  0  0  0  0  0  0  0999 V2000
    1.6069   -0.7891   -0.2064 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.6394    0.1570   -0.2534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6446   -0.1554   -0.2006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6123    0.7943   -0.2478 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.9543    1.1867   -0.3362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9436   -1.1935   -0.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  2  5  1  0
  3  6  1  0
M  END