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	hartrees
Energy at 0K	-1355.184229
Energy at 298.15K	-1355.184480
HF Energy	-1354.426009
Nuclear repulsion energy	244.861012

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1171	1127	284.07
2	A₁	512	493	15.81
3	A₁	297	286	0.05
4	B₁	479	461	1.12
5	B₂	840	809	196.61
6	B₂	306	294	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.135
S2	0.000	1.740
Cl3	1.431	-0.843
Cl4	-1.431	-0.843

	C1	S2	Cl3	Cl4
C1		1.6051	1.7332	1.7332
S2	1.6051		2.9529	2.9529
Cl3	1.7332	2.9529		2.8619
Cl4	1.7332	2.9529	2.8619

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.348		S2	C1	Cl4	124.348
Cl3	C1	Cl4	111.304

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: QCISD/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/aug-cc-pVTZ

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)