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	hartrees
Energy at 0K	-93.170029
Energy at 298.15K	-93.170145
HF Energy	-92.882117
Nuclear repulsion energy	23.727585

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3512	3329	68.73
2	Σ	2241	2124	1.36
3	Π	748	709	36.13
3	Π	748	709	36.13

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.504
H2	0.000	0.000	-1.582
N3	0.000	0.000	0.658

	C1	H2	N3
C1		1.0783	1.1618
H2	1.0783		2.2401
N3	1.1618	2.2401

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

using model chemistry: MP3/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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