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	hartrees
Energy at 0K	-93.194648
Energy at 298.15K	-93.194763
HF Energy	-92.894744
Nuclear repulsion energy	23.867967

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3465	3310	58.17
2	Σ	2181	2083	0.51
3	Π	749	716	40.60
3	Π	749	716	40.60

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.501
H2	0.000	0.000	-1.571
N3	0.000	0.000	0.654

	C1	H2	N3
C1		1.0700	1.1554
H2	1.0700		2.2254
N3	1.1554	2.2254

All results from a given calculation for HCN (Hydrogen cyanide)

using model chemistry: CCD/6-311G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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