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	hartrees
Energy at 0K	-1139.299842
Energy at 298.15K	-1139.300108
HF Energy	-1138.729143
Nuclear repulsion energy	312.826516

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1711	1633	0.00
2	A_g	929	887	0.00
3	A_g	564	538	0.00
4	A_g	370	354	0.00
5	A_g	266	254	0.00
6	A_u	403	385	19.03
7	A_u	57	54	0.43
8	B_g	718	685	0.00
9	B_u	1738	1659	298.80
10	B_u	653	623	501.27
11	B_u	423	403	40.56
12	B_u	201	192	10.82

Atom	x (Å)	y (Å)
C1	-0.222	0.737
C2	0.222	-0.737
O3	-1.348	1.181
O4	1.348	-1.181
Cl5	1.348	1.827
Cl6	-1.348	-1.827

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5405	1.2095	2.4788	1.9110	2.8003
C2	1.5405		2.4788	1.2095	2.8003	1.9110
O3	1.2095	2.4788		3.5835	2.7719	3.0073
O4	2.4788	1.2095	3.5835		3.0073	2.7719
Cl5	1.9110	2.8003	2.7719	3.0073		4.5402
Cl6	2.8003	1.9110	3.0073	2.7719	4.5402

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	128.272	C1	C2	Cl6	107.970
C2	C1	O3	128.272	C2	C1	Cl5	107.970
O3	C1	Cl5	123.759	O4	C2	Cl6	123.759

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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