quack/mol/cyanoformaldehyde.xyz

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346 B
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Cyanoformaldehyde,^1A^\prime,CC3,aug-cc-pVTZ
C -0.48452250 0.00000000 -0.64836291
C -0.00577977 0.00000000 0.73832485
N 0.33957439 0.00000000 1.84587767
O 0.26900027 0.00000000 -1.58931955
H -1.57272638 0.00000000 -0.75442506