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	hartrees
Energy at 0K	-1355.226178
Energy at 298.15K	-1355.226384
HF Energy	-1354.425527
Nuclear repulsion energy	243.995141

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1144	1106
2	A₁	500	483
3	A₁	292	283
4	B₁	466	450
5	B₂	811	784
6	B₂	300	290

Atom	y (Å)	z (Å)
C1	0.000	0.136
S2	0.000	1.748
Cl3	1.435	-0.847
Cl4	-1.435	-0.847

	C1	S2	Cl3	Cl4
C1		1.6117	1.7391	1.7391
S2	1.6117		2.9649	2.9649
Cl3	1.7391	2.9649		2.8691
Cl4	1.7391	2.9649	2.8691

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.421		S2	C1	Cl4	124.421
Cl3	C1	Cl4	111.157

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: QCISD(T)/aug-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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All results from a given calculation for Cl2CS (Thiophosgene)

using model chemistry: QCISD(T)/aug-cc-pVTZ

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)