File: bef2r.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 (12 lines) | stat: -rw-r--r-- 315 bytes parent folder | download | duplicates (2)
1
2
3
4
5
6
7
8
9
10
11
12
*
*  -246.864
*
 SYMMETRY PM7
Beryllium difluoride
 GR=JANAF86 <Be-F>
  F     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Be     1.40000000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.40000000 +0  180.0000000 +0    0.0000000 +0     2     1     0
 
   2  1    3