File: github2040_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 (20 lines) | stat: -rw-r--r-- 419 bytes parent folder | download | duplicates (5)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20

  Mrv1805 09141811042D

  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS 5 3 0 0 0
M  V30 BEGIN ATOM
M  V30 1 * -8.4163 0.715 0 0
M  V30 2 Fe -8.4163 -1.595 0 0
M  V30 3 C -9.75 0.4583 0 0
M  V30 4 C -8.4163 1.2283 0 0
M  V30 5 C -7.0826 0.4583 0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 2 ENDPTS=(3 5 4 3) ATTACH=ANY
M  V30 2 4 4 5
M  V30 3 4 3 4
M  V30 END BOND
M  V30 END CTAB
M  END