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	hartrees
Energy at 0K	-491.115825
Energy at 298.15K	-491.116545
HF Energy	-490.463331
Nuclear repulsion energy	79.408005

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3700	3587
2	A'	1988	1927
3	A'	860	834
4	A'	616	597
5	A'	449	435
6	A"	475	461

Atom	x (Å)	y (Å)
N1	-0.180	1.695
C2	0.000	0.496
S3	0.050	-1.082
H4	0.459	2.469

	N1	C2	S3	H4
N1		1.2125	2.7865	1.0030
C2	1.2125		1.5787	2.0253
S3	2.7865	1.5787		3.5741
H4	1.0030	2.0253	3.5741

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

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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