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	hartrees
Energy at 0K	-437.513802
Energy at 298.15K	-437.515186
HF Energy	-437.513802
Nuclear repulsion energy	44.795895

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3060	2958	32.76
2	A₁	1494	1444	4.23
3	A₁	1087	1051	13.61
4	B₁	1029	995	40.18
5	B₂	3142	3037	8.02
6	B₂	1006	972	2.40

Atom	y (Å)	z (Å)
S1	0.000	0.585
C2	0.000	-1.026
H3	0.921	-1.604
H4	-0.921	-1.604

	S1	C2	H3	H4
S1		1.6106	2.3752	2.3752
C2	1.6106		1.0877	1.0877
H3	2.3752	1.0877		1.8419
H4	2.3752	1.0877	1.8419

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	122.148		S1	C2	H4	122.148
H3	C2	H4	115.704

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: B3LYP/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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Number	Element	Mulliken
1	S	-0.079
2	C	-0.202
3	H	0.141
4	H	0.141

	x	y	z	Total
	0.000	0.000	-1.732	1.732
CHELPG
AIM
ESP	0.000	0.000	-1.785	1.785

<r²>	30.574
(<r²>)^1/2	5.529

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: B3LYP/cc-pVTZ

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)