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	hartrees
Energy at 0K	-491.419798
Energy at 298.15K
HF Energy	-491.266482
Nuclear repulsion energy	77.912209

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2684	2583	3.95
2	A'	2200	2117	9.97
3	A'	970	933	7.54
4	A'	693	667	0.22
5	A'	321	309	3.54
6	A"	381	366	0.65

Atom	x (Å)	y (Å)
S1	-0.068	-1.010
C2	0.000	0.701
N3	-0.027	1.875
H4	1.277	-1.177

	S1	C2	N3	H4
S1		1.7120	2.8847	1.3553
C2	1.7120		1.1740	2.2708
N3	2.8847	1.1740		3.3183
H4	1.3553	2.2708	3.3183

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

using model chemistry: B2PLYP=FULLultrafine/aug-cc-pVDZ

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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