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	hartrees
Energy at 0K	-437.294529
Energy at 298.15K
HF Energy	-437.195426
Nuclear repulsion energy	44.386466

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3091	3091	30.60	153.17	0.10	0.19
2	A₁	1488	1488	3.60	4.77	0.74	0.85
3	A₁	1075	1075	10.23	36.06	0.11	0.20
4	B₁	1032	1032	41.27	0.05	0.75	0.86
5	B₂	3189	3189	4.29	115.55	0.75	0.86
6	B₂	1002	1002	2.16	0.22	0.75	0.86

Atom	y (Å)	z (Å)
S1	0.000	0.590
C2	0.000	-1.036
H3	0.931	-1.614
H4	-0.931	-1.614

	S1	C2	H3	H4
S1		1.6267	2.3930	2.3930
C2	1.6267		1.0954	1.0954
H3	2.3930	1.0954		1.8612
H4	2.3930	1.0954	1.8612

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	121.839		S1	C2	H4	121.839
H3	C2	H4	116.323

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: B2PLYP=FULLultrafine/daug-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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All results from a given calculation for H2CS (Thioformaldehyde)

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

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)