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	hartrees
Energy at 0K	-1355.210696
Energy at 298.15K	-1355.210950
HF Energy	-1354.439776
Nuclear repulsion energy	245.862259

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1176	1116	244.25
2	A₁	516	489	20.94
3	A₁	299	283	0.27
4	B₁	485	460	1.41
5	B₂	828	785	230.56
6	B₂	307	291	0.02

Atom	y (Å)	z (Å)
C1	0.000	0.135
S2	0.000	1.737
Cl3	1.422	-0.841
Cl4	-1.422	-0.841

	C1	S2	Cl3	Cl4
C1		1.6015	1.7249	1.7249
S2	1.6015		2.9443	2.9443
Cl3	1.7249	2.9443		2.8434
Cl4	1.7249	2.9443	2.8434

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
S2	C1	Cl3	124.490		S2	C1	Cl4	124.490
Cl3	C1	Cl4	111.020

All results from a given calculation for Cl₂CS (Thiophosgene)

using model chemistry: MP2/cc-pVQZ

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: MP2/cc-pVQZ

States and conformations

All results from a given calculation for Cl₂CS (Thiophosgene)