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	hartrees
Energy at 0K	-93.184843
Energy at 298.15K	-93.184921
HF Energy	-92.882816
Nuclear repulsion energy	23.379344

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	3452	3452	74.17	38.53	0.19	0.32
2	Σ	1991	1991	0.56	47.90	0.07	0.12
3	Π	700	700	38.53	0.12	0.75	0.86
3	Π	700	700	38.53	0.12	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.514
H2	0.000	0.000	-1.592
N3	0.000	0.000	0.668

	C1	H2	N3
C1		1.0771	1.1827
H2	1.0771		2.2598
N3	1.1827	2.2598

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

using model chemistry: MP2/daug-cc-pVDZ

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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