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	hartrees
Energy at 0K	-1032.566524
Energy at 298.15K
Nuclear repulsion energy	192.068265

Atom	y (Å)	z (Å)
O1	0.000	1.680
C2	0.000	0.495
Cl3	1.439	-0.483
Cl4	-1.439	-0.483

	O1	C2	Cl3	Cl4
O1		1.1846	2.5972	2.5972
C2	1.1846		1.7395	1.7395
Cl3	2.5972	1.7395		2.8775
Cl4	2.5972	1.7395	2.8775

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	Cl3	124.197		O1	C2	Cl4	124.197
Cl3	C2	Cl4	111.606

All results from a given calculation for CCl₂O (Phosgene)

using model chemistry: MP2/cc-pV(T+d)Z

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: MP2/cc-pV(T+d)Z

States and conformations

All results from a given calculation for CCl₂O (Phosgene)