File: DISP.mop

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mopac 23.1.2-1
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file content (27 lines) | stat: -rw-r--r-- 440 bytes parent folder | download | duplicates (2) 
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PM6-D3H4 DISP 1SCF
comment1
comment2
C -0.04  2.00 0.0
C  0.04 -2.00 0.0
O  1.17  1.43 0.0
O -1.07  1.33 0.0
O  1.07 -1.33 0.0
O -1.17 -1.43 0.0
H  0.04  3.08 0.0
H  0.04 -3.08 0.0
H  1.15  0.38 0.0
H -1.15 -0.38 0.0

PM6-D3H4 DISP(1.0) 1SCF
comment1
comment2
C -0.04  2.00 0.0
C  0.04 -2.00 0.0
O  1.17  1.43 0.0
O -1.07  1.33 0.0
O  1.07 -1.33 0.0
O -1.17 -1.43 0.0
H  0.04  3.08 0.0
H  0.04 -3.08 0.0
H  1.15  0.38 0.0
H -1.15 -0.38 0.0