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	hartrees
Energy at 0K	-490.810619
Energy at 298.15K	-490.811360
HF Energy	-490.392966
Nuclear repulsion energy	79.430961

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3789	3548	272.33
2	A'	2069	1938	595.09
3	A'	905	847	1.80
4	A'	661	619	444.16
5	A'	453	424	60.21
6	A"	468	438	5.20

Atom	x (Å)	y (Å)
N1	-0.203	1.692
C2	0.000	0.492
S3	0.063	-1.080
H4	0.411	2.487

	N1	C2	S3	H4
N1		1.2172	2.7852	1.0044
C2	1.2172		1.5736	2.0370
S3	2.7852	1.5736		3.5844
H4	1.0044	2.0370	3.5844

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

using model chemistry: MP2/6-31G**

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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