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	hartrees
Energy at 0K	-229.673932
Energy at 298.15K	-229.681046
Nuclear repulsion energy	129.638290

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3845	3687	0.00
2	A_g	3057	2931	0.00
3	A_g	1519	1457	0.00
4	A_g	1475	1415	0.00
5	A_g	1287	1235	0.00
6	A_g	1082	1038	0.00
7	A_g	1008	967	0.00
8	A_g	477	458	0.00
9	A_u	3129	3001	63.79
10	A_u	1220	1170	0.87
11	A_u	834	800	1.42
12	A_u	249	238	204.80
13	A_u	116	112	38.26
14	B_g	3106	2978	0.00
15	B_g	1300	1247	0.00
16	B_g	1157	1109	0.00
17	B_g	245	235	0.00
18	B_u	3845	3688	83.89
19	B_u	3061	2935	88.04
20	B_u	1524	1461	5.46
21	B_u	1392	1335	10.23
22	B_u	1191	1142	78.22
23	B_u	1059	1016	208.38
24	B_u	290	278	20.20

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.759	0.000
C2	0.000	-0.759	0.000
O3	1.379	-1.162	0.000
O4	-1.379	1.162	0.000
H5	1.410	-2.127	0.000
H6	-1.410	2.127	0.000
H7	-0.528	-1.126	0.897
H8	-0.528	-1.126	-0.897
H9	0.528	1.126	0.897
H10	0.528	1.126	-0.897

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5189	2.3651	1.4364	3.2126	1.9644	2.1538	2.1538	1.1037	1.1037
C2	1.5189		1.4364	2.3651	1.9644	3.2126	1.1037	1.1037	2.1538	2.1538
O3	2.3651	1.4364		3.6065	0.9656	4.3124	2.1075	2.1075	2.6010	2.6010
O4	1.4364	2.3651	3.6065		4.3124	0.9656	2.6010	2.6010	2.1075	2.1075
H5	3.2126	1.9644	0.9656	4.3124		5.1042	2.3585	2.3585	3.4881	3.4881
H6	1.9644	3.2126	4.3124	0.9656	5.1042		3.4881	3.4881	2.3585	2.3585
H7	2.1538	1.1037	2.1075	2.6010	2.3585	3.4881		1.7948	2.4871	3.0671
H8	2.1538	1.1037	2.1075	2.6010	2.3585	3.4881	1.7948		3.0671	2.4871
H9	1.1037	2.1538	2.6010	2.1075	3.4881	2.3585	2.4871	3.0671		1.7948
H10	1.1037	2.1538	2.6010	2.1075	3.4881	2.3585	3.0671	2.4871	1.7948

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.282	C1	C2	H7	109.396
C1	C2	H8	109.396	C1	O4	H6	108.134
C2	C1	O4	106.282	C2	C1	H9	109.396
C2	C1	H10	109.396	C2	O3	H5	108.134
O3	C2	H7	111.461	O3	C2	H8	111.461
O4	C1	H9	111.461	O4	C1	H10	111.461
H7	C2	H8	108.794	H9	C1	H10	108.794

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

using model chemistry: MP2/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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All results from a given calculation for C2H6O2 (1,2-Ethanediol)

using model chemistry: MP2/aug-cc-pVDZ

States and conformations

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