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	hartrees
Energy at 0K	-491.501348
Energy at 298.15K	-491.501952
HF Energy	-491.304383
Nuclear repulsion energy	78.674606

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2700	2590	5.22
2	A'	2217	2127	10.17
3	A'	984	944	7.79
4	A'	700	671	0.29
5	A'	333	320	3.74
6	A"	394	378	0.83

Atom	x (Å)	y (Å)
S1	-0.068	-1.000
C2	0.000	0.695
N3	-0.024	1.856
H4	1.264	-1.165

	S1	C2	N3	H4
S1		1.6969	2.8566	1.3426
C2	1.6969		1.1610	2.2488
N3	2.8566	1.1610		3.2839
H4	1.3426	2.2488	3.2839

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

using model chemistry: B2PLYP=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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