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	hartrees
Energy at 0K	-1144.789206
Energy at 298.15K	-1144.789347
HF Energy	-1144.232645
Nuclear repulsion energy	311.085957

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1596	1541	0.00
2	A_g	970	937	0.00
3	A_g	567	548	0.00
4	A_g	381	368	0.00
5	A_g	264	255	0.00
6	A_u	363	351	18.86
7	A_u	24	23	0.16
8	B_g	665	642	0.00
9	B_u	1622	1566	310.25
10	B_u	668	645	436.51
11	B_u	435	420	19.28
12	B_u	193	186	5.81

Atom	x (Å)	y (Å)
C1	-0.191	0.762
C2	0.191	-0.762
O3	-1.337	1.222
O4	1.337	-1.222
Cl5	1.337	1.850
Cl6	-1.337	-1.850

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5709	1.2345	2.5038	1.8759	2.8520
C2	1.5709		2.5038	1.2345	2.8520	1.8759
O3	1.2345	2.5038		3.6219	2.7466	3.0716
O4	2.5038	1.2345	3.6219		3.0716	2.7466
Cl5	1.8759	2.8520	2.7466	3.0716		4.5648
Cl6	2.8520	1.8759	3.0716	2.7466	4.5648

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	125.958	C1	C2	Cl6	111.366
C2	C1	O3	125.958	C2	C1	Cl5	111.366
O3	C1	Cl5	122.676	O4	C2	Cl6	122.676

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

using model chemistry: MP2/SDD

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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