File: scl2r.mop

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*
*    29.000
*
 SYMMETRY PM7
Sulfur dichloride
 GR=JANAF86 <S-Cl> <Cl-S-Cl>
 Cl     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  S     2.01500000 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.01500000 +0  102.7300000 +1    0.0000000 +0     2     1     0
 
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