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	hartrees
Energy at 0K	-1144.679106
Energy at 298.15K	-1144.679627
HF Energy	-1144.223955
Nuclear repulsion energy	318.967551

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1828	1709	0.00
2	A_g	1124	1051	0.00
3	A_g	636	595	0.00
4	A_g	434	406	0.00
5	A_g	287	268	0.00
6	A_u	406	379	28.82
7	A_u	40	37	0.41
8	B_g	738	690	0.00
9	B_u	1847	1727	353.41
10	B_u	764	715	433.65
11	B_u	489	458	6.57
12	B_u	211	197	5.18

Atom	x (Å)	y (Å)
C1	-0.173	0.744
C2	0.173	-0.744
O3	-1.295	1.179
O4	1.295	-1.179
Cl5	1.295	1.827
Cl6	-1.295	-1.827

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5267	1.2040	2.4187	1.8240	2.8047
C2	1.5267		2.4187	1.2040	2.8047	1.8240
O3	1.2040	2.4187		3.5027	2.6700	3.0056
O4	2.4187	1.2040	3.5027		3.0056	2.6700
Cl5	1.8240	2.8047	2.6700	3.0056		4.4783
Cl6	2.8047	1.8240	3.0056	2.6700	4.4783

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	124.262	C1	C2	Cl6	113.359
C2	C1	O3	124.262	C2	C1	Cl5	113.359
O3	C1	Cl5	122.379	O4	C2	Cl6	122.379

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

using model chemistry: CID/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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