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	hartrees
Energy at 0K	-229.568624
Energy at 298.15K	-229.575839
HF Energy	-228.919995
Nuclear repulsion energy	130.203646

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3807	3604	0.00
2	A_g	3052	2889	0.00
3	A_g	1584	1499	0.00
4	A_g	1544	1462	0.00
5	A_g	1337	1265	0.00
6	A_g	1134	1073	0.00
7	A_g	1031	976	0.00
8	A_g	490	464	0.00
9	A_u	3111	2944	104.47
10	A_u	1258	1191	2.95
11	A_u	856	810	3.88
12	A_u	261	247	277.62
13	A_u	137	130	26.43
14	B_g	3086	2921	0.00
15	B_g	1337	1266	0.00
16	B_g	1198	1134	0.00
17	B_g	256	243	0.00
18	B_u	3808	3604	48.57
19	B_u	3056	2892	86.90
20	B_u	1592	1507	6.18
21	B_u	1452	1375	15.47
22	B_u	1229	1163	130.82
23	B_u	1121	1061	178.16
24	B_u	303	287	24.49

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.758	0.000
C2	0.000	-0.758	0.000
O3	1.366	-1.164	0.000
O4	-1.366	1.164	0.000
H5	1.390	-2.132	0.000
H6	-1.390	2.132	0.000
H7	-0.535	-1.119	0.891
H8	-0.535	-1.119	-0.891
H9	0.535	1.119	0.891
H10	0.535	1.119	-0.891

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5151	2.3573	1.4250	3.2067	1.9548	2.1448	2.1448	1.1001	1.1001
C2	1.5151		1.4250	2.3573	1.9548	3.2067	1.1001	1.1001	2.1448	2.1448
O3	2.3573	1.4250		3.5888	0.9690	4.2962	2.0996	2.0996	2.5874	2.5874
O4	1.4250	2.3573	3.5888		4.2962	0.9690	2.5874	2.5874	2.0996	2.0996
H5	3.2067	1.9548	0.9690	4.2962		5.0905	2.3504	2.3504	3.4778	3.4778
H6	1.9548	3.2067	4.2962	0.9690	5.0905		3.4778	3.4778	2.3504	2.3504
H7	2.1448	1.1001	2.0996	2.5874	2.3504	3.4778		1.7821	2.4798	3.0537
H8	2.1448	1.1001	2.0996	2.5874	2.3504	3.4778	1.7821		3.0537	2.4798
H9	1.1001	2.1448	2.5874	2.0996	3.4778	2.3504	2.4798	3.0537		1.7821
H10	1.1001	2.1448	2.5874	2.0996	3.4778	2.3504	3.0537	2.4798	1.7821

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.560	C1	C2	H7	109.165
C1	C2	H8	109.165	C1	O4	H6	107.961
C2	C1	O4	106.560	C2	C1	H9	109.165
C2	C1	H10	109.165	C2	O3	H5	107.961
O3	C2	H7	111.857	O3	C2	H8	111.857
O4	C1	H9	111.857	O4	C1	H10	111.857
H7	C2	H8	108.182	H9	C1	H10	108.182

All results from a given calculation for C₂H₆O₂ (1,2-Ethanediol)

using model chemistry: CCD/6-31G*

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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All results from a given calculation for C2H6O2 (1,2-Ethanediol)

using model chemistry: CCD/6-31G*

States and conformations

All results from a given calculation for C₂H₆O₂ (1,2-Ethanediol)