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	hartrees
Energy at 0K	-490.921886
Energy at 298.15K	-490.922631
HF Energy	-490.460065
Nuclear repulsion energy	80.452849

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3847	3555	367.70
2	A'	2125	1963	1064.57
3	A'	911	842	13.18
4	A'	585	540	232.36
5	A'	445	411	322.17
6	A"	523	483	1.75

Atom	x (Å)	y (Å)
N1	-0.122	1.674
C2	0.000	0.494
S3	0.021	-1.070
H4	0.507	2.446

	N1	C2	S3	H4
N1		1.1863	2.7481	0.9956
C2	1.1863		1.5645	2.0169
S3	2.7481	1.5645		3.5498
H4	0.9956	2.0169	3.5498

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

using model chemistry: CID/6-311+G(3df,2p)

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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