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	hartrees
Energy at 0K	-302.440005
Energy at 298.15K
HF Energy	-301.519829
Nuclear repulsion energy	157.299877

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3039	2964
2	A₁	1803	1758
3	A₁	1408	1373
4	A₁	1104	1077
5	A₁	515	502
6	A₁	274	268
7	A₂	982	958
8	A₂	174	170
9	B₁	991	966
10	B₁	125	122
11	B₂	3019	2945
12	B₂	1725	1683
13	B₂	1355	1322
14	B₂	1011	986
15	B₂	680	663

Atom	y (Å)	z (Å)
O1	0.000	0.410
C2	1.187	-0.326
C3	-1.187	-0.326
O4	2.265	0.217
O5	-2.265	0.217
H6	1.023	-1.424
H7	-1.023	-1.424

	O1	C2	C3	O4	O5	H6	H7
O1		1.3960	1.3960	2.2733	2.2733	2.1000	2.1000
C2	1.3960		2.3730	1.2075	3.4941	1.1104	2.4676
C3	1.3960	2.3730		3.4941	1.2075	2.4676	1.1104
O4	2.2733	1.2075	3.4941		4.5302	2.0582	3.6751
O5	2.2733	3.4941	1.2075	4.5302		3.6751	2.0582
H6	2.1000	1.1104	2.4676	2.0582	3.6751		2.0463
H7	2.1000	2.4676	1.1104	3.6751	2.0582	2.0463

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	O4	121.483	O1	C2	H6	113.337
O1	C3	O5	121.483	C2	O1	C3	116.408
O4	C2	H6	125.180

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

using model chemistry: MP4=FULL/aug-cc-pVDZ

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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