File: 40e2130653710a7aad2b0185726ba672ccb76f0f

package info (click to toggle)
rdkit 202503.1-4
  • links: PTS, VCS
  • area: main
  • in suites: trixie
  • 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: 578; xml: 229; fortran: 183; sh: 105
file content (14 lines) | stat: -rw-r--r-- 476 bytes parent folder | download | duplicates (6) 
1
2
3
4
5
6
7
8
9
10
11
12
13
14
 

     RDKit          3D

  5  4  0  0  0  0  0  0  0  0999 V2000
   -1.4068   -1.0279    0.1601 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4312    0.0177    0.4262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9222    1.2845   -0.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8340   -0.4017   -0.2550 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9262    0.1273   -0.1000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
M  END000