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	hartrees
Energy at 0K	-1139.323729
Energy at 298.15K	-1139.323855
HF Energy	-1138.725007
Nuclear repulsion energy	310.458704

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	1693	1642
2	A_g	892	865
3	A_g	531	515
4	A_g	355	345
5	A_g	256	248
6	A_u	387	375
7	A_u	52	51
8	B_g	690	669
9	B_u	1707	1655
10	B_u	631	612
11	B_u	404	391
12	B_u	193	187

Atom	x (Å)	y (Å)
C1	-0.228	0.744
C2	0.228	-0.744
O3	-1.359	1.187
O4	1.359	-1.187
Cl5	1.359	1.840
Cl6	-1.359	-1.840

	C1	C2	O3	O4	Cl5	Cl6
C1		1.5573	1.2144	2.4997	1.9290	2.8214
C2	1.5573		2.4997	1.2144	2.8214	1.9290
O3	1.2144	2.4997		3.6086	2.7961	3.0268
O4	2.4997	1.2144	3.6086		3.0268	2.7961
Cl5	1.9290	2.8214	2.7961	3.0268		4.5757
Cl6	2.8214	1.9290	3.0268	2.7961	4.5757

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O4	128.388	C1	C2	Cl6	107.576
C2	C1	O3	128.388	C2	C1	Cl5	107.576
O3	C1	Cl5	124.036	O4	C2	Cl6	124.036

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

using model chemistry: MP4/3-21G

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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