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	hartrees
Energy at 0K	-1139.690748
Energy at 298.15K	-1139.691245
HF Energy	-1138.952992
Nuclear repulsion energy	321.826326

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1725	1658	0.00
2	A_g	994	955	0.00
3	A_g	599	576	0.00
4	A_g	412	396	0.00
5	A_g	292	280	0.00
6	A_u	416	400	17.69
7	A_u	64	62	0.07
8	B_g	742	714	0.00
9	B_u	1744	1676	230.48
10	B_u	734	705	449.25
11	B_u	472	454	12.73
12	B_u	212	204	6.93

Atom	x (Å)	y (Å)
C1	-0.175	0.756
C2	0.175	-0.756
O3	-1.305	1.205
O4	1.305	-1.205
Cl5	1.305	1.750
Cl6	-1.305	-1.750

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5526	1.2155	2.4568	1.7826	2.7493
C2	1.5526		2.4568	1.2155	2.7493	1.7826
O3	1.2155	2.4568		3.5519	2.6661	2.9549
O4	2.4568	1.2155	3.5519		2.9549	2.6661
Cl5	1.7826	2.7493	2.6661	2.9549		4.3660
Cl6	2.7493	1.7826	2.9549	2.6661	4.3660

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	124.682	C1	C2	Cl6	110.850
C2	C1	O3	124.682	C2	C1	Cl5	110.850
O3	C1	Cl5	124.468	O4	C2	Cl6	124.468

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

using model chemistry: QCISD/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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