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	hartrees
Energy at 0K	-490.945169
Energy at 298.15K	-490.945844
HF Energy	-490.402137
Nuclear repulsion energy	78.791642

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2749	2588	3.38
2	A'	2326	2190	5.61
3	A'	1006	948	8.97
4	A'	718	676	0.48
5	A'	365	343	5.32
6	A"	428	403	2.34

Atom	x (Å)	y (Å)
S1	-0.079	-0.998
C2	0.000	0.695
N3	0.002	1.854
H4	1.249	-1.172

	S1	C2	N3	H4
S1		1.6955	2.8531	1.3391
C2	1.6955		1.1584	2.2459
N3	2.8531	1.1584		3.2717
H4	1.3391	2.2459	3.2717

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

using model chemistry: CCSD=FULL/6-31G(2df,p)

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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