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	hartrees
Energy at 0K	-1139.698817
Energy at 298.15K	-1139.699305
HF Energy	-1138.951105
Nuclear repulsion energy	321.773387

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1649	1563	0.00
2	A_g	970	919	0.00
3	A_g	588	557	0.00
4	A_g	408	386	0.00
5	A_g	294	279	0.00
6	A_u	421	399	16.10
7	A_u	66	63	0.02
8	B_g	753	714	0.00
9	B_u	1678	1591	232.36
10	B_u	719	682	513.27
11	B_u	470	445	26.69
12	B_u	214	203	9.31

Atom	x (Å)	y (Å)
C1	-0.179	0.755
C2	0.179	-0.755
O3	-1.311	1.213
O4	1.311	-1.213
Cl5	1.311	1.735
Cl6	-1.311	-1.735

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5521	1.2210	2.4687	1.7834	2.7350
C2	1.5521		2.4687	1.2210	2.7350	1.7834
O3	1.2210	2.4687		3.5723	2.6735	2.9478
O4	2.4687	1.2210	3.5723		2.9478	2.6735
Cl5	1.7834	2.7350	2.6735	2.9478		4.3489
Cl6	2.7350	1.7834	2.9478	2.6735	4.3489

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	125.382	C1	C2	Cl6	109.972
C2	C1	O3	125.382	C2	C1	Cl5	109.972
O3	C1	Cl5	124.646	O4	C2	Cl6	124.646

All results from a given calculation for ClCOClCO (Oxalyl chloride)

using model chemistry: MP2=FULL/3-21G*

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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