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	hartrees
Energy at 0K	-1354.463025
Energy at 298.15K	-1354.463052
HF Energy	-1354.189829
Nuclear repulsion energy	233.318677

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1062	1024	215.31
2	A₁	431	416	18.50
3	A₁	274	264	1.09
4	B₁	437	421	0.59
5	B₂	714	688	201.61
6	B₂	292	281	0.03

Atom	y (Å)	z (Å)
C1	0.000	0.157
S2	0.000	1.816
Cl3	1.509	-0.882
Cl4	-1.509	-0.882

	C1	S2	Cl3	Cl4
C1		1.6581	1.8328	1.8328
S2	1.6581		3.0913	3.0913
Cl3	1.8328	3.0913		3.0189
Cl4	1.8328	3.0913	3.0189

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.555		S2	C1	Cl4	124.555
Cl3	C1	Cl4	110.890

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: QCISD/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: QCISD/6-31G

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)