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	hartrees
Energy at 0K	-436.678130
Energy at 298.15K	-436.677931
HF Energy	-436.572797
Nuclear repulsion energy	38.861388

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3130	3003	8.53
2	A'	1207	1158	8.52
3	A'	840	806	71.21

Atom	x (Å)	y (Å)
C1	0.035	1.058
H2	-0.771	1.785
S3	0.035	-0.508

	C1	H2	S3
C1		1.0857	1.5663
H2	1.0857		2.4311
S3	1.5663	2.4311

All results from a given calculation for HCS (Thioformyl radical)

using model chemistry: B2PLYP/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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