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	hartrees
Energy at 0K	-93.318997
Energy at 298.15K	-93.319063
HF Energy	-92.907551
Nuclear repulsion energy	23.774447

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	3461	3354
2	Σ	2038	1975
3	Π	688	667
3	Π	687	666

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.506
H2	0.000	0.000	-1.566
N3	0.000	0.000	0.657

	C1	H2	N3
C1		1.0606	1.1631
H2	1.0606		2.2237
N3	1.1631	2.2237

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

using model chemistry: MP4=FULL/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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