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	hartrees
Energy at 0K	-1032.272625
Energy at 298.15K	-1032.273178
HF Energy	-1031.677366
Nuclear repulsion energy	190.944284

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1886	1796	293.43
2	A₁	591	563	18.01
3	A₁	315	300	0.00
4	B₁	594	566	10.04
5	B₂	907	863	478.41
6	B₂	457	435	0.00

Atom	y (Å)	z (Å)
O1	0.000	1.682
C2	0.000	0.496
Cl3	1.455	-0.483
Cl4	-1.455	-0.483

	O1	C2	Cl3	Cl4
O1		1.1865	2.6088	2.6088
C2	1.1865		1.7535	1.7535
Cl3	2.6088	1.7535		2.9094
Cl4	2.6088	1.7535	2.9094

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	Cl3	123.942		O1	C2	Cl4	123.942
Cl3	C2	Cl4	112.116

All results from a given calculation for CCl₂O (Phosgene)

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 CCl2O (Phosgene)

using model chemistry: QCISD/6-31G*

States and conformations

All results from a given calculation for CCl₂O (Phosgene)