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	hartrees
Energy at 0K	-1354.883815
Energy at 298.15K	-1354.884098
HF Energy	-1354.298952
Nuclear repulsion energy	244.611274

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1193	1133	269.08
2	A₁	523	497	18.16
3	A₁	309	293	0.30
4	B₁	491	467	0.67
5	B₂	867	824	212.29
6	B₂	319	303	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.132
S2	0.000	1.738
Cl3	1.436	-0.841
Cl4	-1.436	-0.841

	C1	S2	Cl3	Cl4
C1		1.6063	1.7347	1.7347
S2	1.6063		2.9521	2.9521
Cl3	1.7347	2.9521		2.8726
Cl4	1.7347	2.9521	2.8726

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.110		S2	C1	Cl4	124.110
Cl3	C1	Cl4	111.781

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: CCSD=FULL/6-31G*

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: CCSD=FULL/6-31G*

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)