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	hartrees
Energy at 0K	-229.728181
Energy at 298.15K	-229.735342
HF Energy	-228.955168
Nuclear repulsion energy	130.885680

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3901	3685	0.00
2	A_g	3070	2899	0.00
3	A_g	1557	1471	0.00
4	A_g	1514	1430	0.00
5	A_g	1310	1237	0.00
6	A_g	1125	1063	0.00
7	A_g	1020	964	0.00
8	A_g	487	460	0.00
9	A_u	3139	2964	78.81
10	A_u	1246	1176	2.18
11	A_u	843	796	2.43
12	A_u	253	239	223.03
13	A_u	128	121	26.83
14	B_g	3113	2940	0.00
15	B_g	1322	1249	0.00
16	B_g	1185	1119	0.00
17	B_g	247	233	0.00
18	B_u	3902	3686	81.19
19	B_u	3076	2905	78.99
20	B_u	1567	1481	5.48
21	B_u	1433	1354	13.39
22	B_u	1212	1144	78.73
23	B_u	1112	1051	203.96
24	B_u	287	271	19.54

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.757	0.000
C2	0.000	-0.757	0.000
O3	1.357	-1.159	0.000
O4	-1.357	1.159	0.000
H5	1.373	-2.118	0.000
H6	-1.373	2.118	0.000
H7	-0.538	-1.112	0.887
H8	-0.538	-1.112	-0.887
H9	0.538	1.112	0.887
H10	0.538	1.112	-0.887

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5135	2.3481	1.4157	3.1862	1.9339	2.1369	2.1369	1.0961	1.0961
C2	1.5135		1.4157	2.3481	1.9339	3.1862	1.0961	1.0961	2.1369	2.1369
O3	2.3481	1.4157		3.5699	0.9591	4.2660	2.0929	2.0929	2.5719	2.5719
O4	1.4157	2.3481	3.5699		4.2660	0.9591	2.5719	2.5719	2.0929	2.0929
H5	3.1862	1.9339	0.9591	4.2660		5.0491	2.3351	2.3351	3.4520	3.4520
H6	1.9339	3.1862	4.2660	0.9591	5.0491		3.4520	3.4520	2.3351	2.3351
H7	2.1369	1.0961	2.0929	2.5719	2.3351	3.4520		1.7733	2.4698	3.0405
H8	2.1369	1.0961	2.0929	2.5719	2.3351	3.4520	1.7733		3.0405	2.4698
H9	1.0961	2.1369	2.5719	2.0929	3.4520	2.3351	2.4698	3.0405		1.7733
H10	1.0961	2.1369	2.5719	2.0929	3.4520	2.3351	3.0405	2.4698	1.7733

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.518	C1	C2	H7	108.888
C1	C2	H8	108.888	C1	O4	H6	107.485
C2	C1	O4	106.518	C2	C1	H9	108.888
C2	C1	H10	108.888	C2	O3	H5	107.485
O3	C2	H7	112.238	O3	C2	H8	112.238
O4	C1	H9	112.238	O4	C1	H10	112.238
H7	C2	H8	107.984	H9	C1	H10	107.984

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

using model chemistry: MP2/6-31G(2df,p)

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: MP2/6-31G(2df,p)

States and conformations

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