File: coobrr.mop

package info (click to toggle)
mopac 22.0.6%2Bdfsg-1
  • links: PTS, VCS
  • area: main
  • in suites: bookworm
  • size: 102,028 kB
  • sloc: f90: 161,334; python: 192; sh: 173; makefile: 5
file content (10 lines) | stat: -rw-r--r-- 300 bytes parent folder | download | duplicates (2)
1
2
3
4
5
6
7
8
9
10
*
*    31.409
*
 PM7
Cobalt(III) oxide bromide
 <Co=O> <Co-Br> GR=PW91D
 Co     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.60132600 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.19152100 +1  179.9996305 +1    0.0000000 +0     1     2     0