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	hartrees
Energy at 0K	-437.223117
Energy at 298.15K	-437.224481
HF Energy	-437.223117
Nuclear repulsion energy	44.330565

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3003	2969	31.25
2	A₁	1456	1440	7.63
3	A₁	1060	1048	10.21
4	B₁	990	979	54.79
5	B₂	3088	3053	8.89
6	B₂	985	973	8.36

Atom	y (Å)	z (Å)
S1	0.000	0.591
C2	0.000	-1.036
H3	0.932	-1.622
H4	-0.932	-1.622

	S1	C2	H3	H4
S1		1.6267	2.4014	2.4014
C2	1.6267		1.1012	1.1012
H3	2.4014	1.1012		1.8642
H4	2.4014	1.1012	1.8642

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	122.175		S1	C2	H4	122.175
H3	C2	H4	115.651

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: PBEPBEultrafine/6-31+G**

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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Number	Element	Mulliken
1	S	-0.095
2	C	-0.288
3	H	0.192
4	H	0.192

	x	y	z	Total
	0.000	0.000	-1.809	1.809
CHELPG
AIM
ESP

<r²>	31.104
(<r²>)^1/2	5.577

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: PBEPBEultrafine/6-31+G**

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)