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	hartrees
Energy at 0K	-437.516469
Energy at 298.15K	-437.517857
HF Energy	-437.516469
Nuclear repulsion energy	45.026796

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3086	2954	31.39
2	A₁	1494	1430	4.24
3	A₁	1119	1071	14.11
4	B₁	1033	989	40.07
5	B₂	3173	3037	7.17
6	B₂	1003	960	2.27

Atom	y (Å)	z (Å)
S1	0.000	0.582
C2	0.000	-1.019
H3	0.920	-1.596
H4	-0.920	-1.596

	S1	C2	H3	H4
S1		1.6010	2.3644	2.3644
C2	1.6010		1.0861	1.0861
H3	2.3644	1.0861		1.8403
H4	2.3644	1.0861	1.8403

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S1	C2	H3	122.093		S1	C2	H4	122.093
H3	C2	H4	115.815

All results from a given calculation for H₂CS (Thioformaldehyde)

using model chemistry: B1B95/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	-0.089
2	C	-0.219
3	H	0.154
4	H	0.154

	x	y	z	Total
	0.000	0.000	-1.724	1.724
CHELPG
AIM
ESP

<r²>	30.253
(<r²>)^1/2	5.500

All results from a given calculation for H2CS (Thioformaldehyde)

using model chemistry: B1B95/cc-pVTZ

States and conformations

All results from a given calculation for H₂CS (Thioformaldehyde)