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	hartrees
Energy at 0K	-490.863187
Energy at 298.15K	-490.863934
HF Energy	-490.431397
Nuclear repulsion energy	79.568440

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3741	3555	263.96
2	A'	2056	1954	645.56
3	A'	899	854	1.93
4	A'	648	616	470.82
5	A'	459	436	68.42
6	A"	474	450	7.11

Atom	x (Å)	y (Å)
N1	-0.183	1.690
C2	0.000	0.492
S3	0.053	-1.080
H4	0.429	2.487

	N1	C2	S3	H4
N1		1.2117	2.7797	1.0048
C2	1.2117		1.5727	2.0404
S3	2.7797	1.5727		3.5863
H4	1.0048	2.0404	3.5863

All results from a given calculation for HNCS (Isothiocyanic acid)

using model chemistry: MP2/6-311G*

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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