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	hartrees
Energy at 0K	-93.234574
Energy at 298.15K	-93.234712
HF Energy	-92.910576
Nuclear repulsion energy	24.117021

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3517	3517	72.57
2	Σ	2257	2257	2.43
3	Π	780	780	34.47
3	Π	780	780	34.47

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.496
H2	0.000	0.000	-1.557
N3	0.000	0.000	0.647

	C1	H2	N3
C1		1.0614	1.1430
H2	1.0614		2.2044
N3	1.1430	2.2044

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

using model chemistry: CID/daug-cc-pVTZ

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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