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	hartrees
Energy at 0K	-300.326842
Energy at 298.15K
HF Energy	-299.777473
Nuclear repulsion energy	156.319610

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3029	2897	94.53
2	A₁	1855	1775	12.52
3	A₁	1525	1459	0.01
4	A₁	1093	1046	103.40
5	A₁	541	518	1.66
6	A₁	268	257	9.24
7	A₂	1064	1017	0.00
8	A₂	160	153	0.00
9	B₁	1059	1013	0.91
10	B₁	113	108	1.56
11	B₂	3009	2878	4.97
12	B₂	1771	1694	432.61
13	B₂	1479	1415	10.92
14	B₂	1097	1050	554.58
15	B₂	710	679	37.02

Atom	y (Å)	z (Å)
O1	0.000	0.401
C2	1.203	-0.327
C3	-1.203	-0.327
O4	2.284	0.222
O5	-2.284	0.222
H6	1.045	-1.416
H7	-1.045	-1.416

	O1	C2	C3	O4	O5	H6	H7
O1		1.4059	1.4059	2.2914	2.2914	2.0954	2.0954
C2	1.4059		2.4059	1.2128	3.5303	1.0999	2.4977
C3	1.4059	2.4059		3.5303	1.2128	2.4977	1.0999
O4	2.2914	1.2128	3.5303		4.5687	2.0536	3.7103
O5	2.2914	3.5303	1.2128	4.5687		3.7103	2.0536
H6	2.0954	1.0999	2.4977	2.0536	3.7103		2.0901
H7	2.0954	2.4977	1.0999	3.7103	2.0536	2.0901

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	O4	121.919	O1	C2	H6	112.916
O1	C3	O5	121.919	C2	O1	C3	117.660
O4	C2	H6	125.165

All results from a given calculation for CHOOCHO (diformyl ether)

using model chemistry: CCD/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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