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	hartrees
Energy at 0K	-1348.526448
Energy at 298.15K	-1348.526721
HF Energy	-1348.078753
Nuclear repulsion energy	244.276054

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1217	1137	284.31
2	A₁	503	470	20.45
3	A₁	308	288	0.39
4	B₁	503	470	0.76
5	B₂	802	749	207.52
6	B₂	324	303	0.01

Atom	y (Å)	z (Å)
C1	0.000	0.142
S2	0.000	1.735
Cl3	1.442	-0.842
Cl4	-1.442	-0.842

	C1	S2	Cl3	Cl4
C1		1.5936	1.7451	1.7451
S2	1.5936		2.9528	2.9528
Cl3	1.7451	2.9528		2.8830
Cl4	1.7451	2.9528	2.8830

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.304		S2	C1	Cl4	124.304
Cl3	C1	Cl4	111.392

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: CISD/3-21G*

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: CISD/3-21G*

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)