Ec/pyrrole/cc-pvdz/pyrrole.xyz

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2020-11-12 11:07:00 +01:00
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C 0.00000000 2.11924634 0.62676569
C 0.00000000 -2.11924634 0.62676569
C 0.00000000 1.34568862 -1.85506908
C 0.00000000 -1.34568862 -1.85506908
N 0.00000000 0.00000000 2.10934391
H 0.00000000 0.00000000 4.00257355
H 0.00000000 3.97648410 1.44830201
H 0.00000000 -3.97648410 1.44830201
H 0.00000000 2.56726559 -3.47837232
H 0.00000000 -2.56726559 -3.47837232