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	hartrees
Energy at 0K	-491.372337
Energy at 298.15K	-491.372908
HF Energy	-491.228031
Nuclear repulsion energy	78.226434

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2729	2588	0.61
2	A'	2236	2121	7.61
3	A'	1007	955	12.32
4	A'	701	665	0.23
5	A'	326	309	4.65
6	A"	383	363	1.97

Atom	x (Å)	y (Å)
S1	-0.071	-1.005
C2	0.000	0.697
N3	-0.019	1.869
H4	1.263	-1.185

	S1	C2	N3	H4
S1		1.7035	2.8739	1.3458
C2	1.7035		1.1715	2.2669
N3	2.8739	1.1715		3.3119
H4	1.3458	2.2669	3.3119

All results from a given calculation for HSCN (thiocyanic acid)

using model chemistry: B2PLYP=FULL/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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