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	hartrees
Energy at 0K	-1354.853280
Energy at 298.15K	-1354.853556
HF Energy	-1354.300906
Nuclear repulsion energy	244.643952

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1213	1143	241.20
2	A₁	524	494	21.07
3	A₁	308	290	0.22
4	B₁	467	440	1.56
5	B₂	865	815	207.65
6	B₂	320	301	0.05

Atom	y (Å)	z (Å)
C1	0.000	0.133
S2	0.000	1.736
Cl3	1.437	-0.841
Cl4	-1.437	-0.841

	C1	S2	Cl3	Cl4
C1		1.6036	1.7357	1.7357
S2	1.6036		2.9506	2.9506
Cl3	1.7357	2.9506		2.8743
Cl4	1.7357	2.9506	2.8743

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.107		S2	C1	Cl4	124.107
Cl3	C1	Cl4	111.785

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: CCD/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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All results from a given calculation for Cl2CS (Thiophosgene)

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

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)