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	hartrees
Energy at 0K	-1354.960163
Energy at 298.15K	-1354.960451
HF Energy	-1354.378290
Nuclear repulsion energy	244.085770

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1176	1122	312.32
2	A₁	513	489	20.39
3	A₁	310	295	0.05
4	B₁	491	469	2.13
5	B₂	840	802	233.24
6	B₂	320	305	0.25

Atom	y (Å)	z (Å)
C1	0.000	0.135
S2	0.000	1.741
Cl3	1.440	-0.843
Cl4	-1.440	-0.843

	C1	S2	Cl3	Cl4
C1		1.6059	1.7405	1.7405
S2	1.6059		2.9578	2.9578
Cl3	1.7405	2.9578		2.8799
Cl4	1.7405	2.9578	2.8799

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.177		S2	C1	Cl4	124.177
Cl3	C1	Cl4	111.647

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: QCISD/6-311G**

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/6-311G**

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)