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	hartrees
Energy at 0K	-491.378002
Energy at 298.15K	-491.378577
HF Energy	-491.231528
Nuclear repulsion energy	78.246906

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2739	2739	0.01
2	A'	2237	2237	7.53
3	A'	999	999	12.60
4	A'	701	701	0.21
5	A'	326	326	4.62
6	A"	382	382	1.99

Atom	x (Å)	y (Å)
S1	-0.071	-1.005
C2	0.000	0.697
N3	-0.018	1.868
H4	1.260	-1.181

	S1	C2	N3	H4
S1		1.7037	2.8740	1.3420
C2	1.7037		1.1715	2.2612
N3	2.8740	1.1715		3.3061
H4	1.3420	2.2612	3.3061

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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