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	hartrees
Energy at 0K	-1032.295487
Energy at 298.15K	-1032.296055
HF Energy	-1031.677840
Nuclear repulsion energy	191.342924

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1907	1811	299.14
2	A₁	596	566	17.79
3	A₁	317	301	0.00
4	B₁	599	569	9.83
5	B₂	917	871	472.29
6	B₂	463	439	0.05

Atom	y (Å)	z (Å)
O1	0.000	1.678
C2	0.000	0.494
Cl3	1.452	-0.482
Cl4	-1.452	-0.482

	O1	C2	Cl3	Cl4
O1		1.1836	2.6026	2.6026
C2	1.1836		1.7498	1.7498
Cl3	2.6026	1.7498		2.9044
Cl4	2.6026	1.7498	2.9044

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	Cl3	123.910		O1	C2	Cl4	123.910
Cl3	C2	Cl4	112.181

All results from a given calculation for CCl₂O (Phosgene)

using model chemistry: CCSD=FULL/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: CCSD=FULL/6-31G*

States and conformations

All results from a given calculation for CCl₂O (Phosgene)