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	hartrees
Energy at 0K	-1145.463002
Energy at 298.15K
HF Energy	-1144.522026
Nuclear repulsion energy	325.193329

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1783	1690	0.00
2	A_g	1080	1024	0.00
3	A_g	618	586	0.00
4	A_g	432	410	0.00
5	A_g	290	275	0.00
6	A_u	378	358	15.95
7	A_u	25i	23i	0.72
8	B_g	705	668	0.00
9	B_u	1810	1716	348.61
10	B_u	771	731	520.93
11	B_u	501	475	8.93
12	B_u	209	198	4.07

Atom	x (Å)	y (Å)
C1	-0.171	0.757
C2	0.171	-0.757
O3	-1.278	1.197
O4	1.278	-1.197
Cl5	1.278	1.754
Cl6	-1.278	-1.754

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5520	1.1913	2.4329	1.7590	2.7444
C2	1.5520		2.4329	1.1913	2.7444	1.7590
O3	1.1913	2.4329		3.5025	2.6158	2.9518
O4	2.4329	1.1913	3.5025		2.9518	2.6158
Cl5	1.7590	2.7444	2.6158	2.9518		4.3408
Cl6	2.7444	1.7590	2.9518	2.6158	4.3408

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	124.433	C1	C2	Cl6	111.813
C2	C1	O3	124.433	C2	C1	Cl5	111.813
O3	C1	Cl5	123.754	O4	C2	Cl6	123.754

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

using model chemistry: MP2/TZVP

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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