File: ph3r.mop

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mopac 22.0.6%2Bdfsg-1
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file content (14 lines) | stat: -rw-r--r-- 413 bytes parent folder | download | duplicates (3) 
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*
*     4.088
*
 SYMMETRY PM7
Phosphine
 GWT=0.333 GR=JANAF86 <P-H> <H-P-H>
  P     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  H     1.42000000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.42000000 +0   93.8300070 +1    0.0000000 +0     1     2     0
  H     1.42000000 +0   93.8300070 +0 -102.5677050 +1     1     2     3
 
   2  1    3    4
   3  2    4