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	hartrees
Energy at 0K	-93.285528
Energy at 298.15K	-93.285609
HF Energy	-92.906547
Nuclear repulsion energy	23.669222

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	3428	3336
2	Σ	2010	1956
3	Π	705	686
3	Π	704	685

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.508
H2	0.000	0.000	-1.575
N3	0.000	0.000	0.660

	C1	H2	N3
C1		1.0673	1.1678
H2	1.0673		2.2351
N3	1.1678	2.2351

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

using model chemistry: MP4/aug-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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