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	hartrees
Energy at 0K	-491.464239
Energy at 298.15K	-491.464826
HF Energy	-491.274265
Nuclear repulsion energy	78.440668

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2649	2649	0.00
2	A'	2223	2223	8.83
3	A'	1005	1005	10.62
4	A'	697	697	0.18
5	A'	330	330	3.82
6	A"	387	387	1.03

Atom	x (Å)	y (Å)
S1	-0.070	-1.003
C2	0.000	0.697
N3	-0.020	1.862
H4	1.267	-1.174

	S1	C2	N3	H4
S1		1.7015	2.8646	1.3487
C2	1.7015		1.1644	2.2603
N3	2.8646	1.1644		3.2975
H4	1.3487	2.2603	3.2975

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

using model chemistry: B2PLYP=FULL/6-311G*

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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