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	hartrees
Energy at 0K	-229.481897
Energy at 298.15K	-229.489186
HF Energy	-228.921675
Nuclear repulsion energy	130.982703

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3950	3649	0.00
2	A_g	3139	2899	0.00
3	A_g	1625	1501	0.00
4	A_g	1587	1466	0.00
5	A_g	1366	1262	0.00
6	A_g	1172	1082	0.00
7	A_g	1052	972	0.00
8	A_g	503	465	0.00
9	A_u	3197	2953	113.65
10	A_u	1298	1199	3.90
11	A_u	875	808	4.23
12	A_u	265	245	291.22
13	A_u	143	132	26.38
14	B_g	3171	2929	0.00
15	B_g	1376	1271	0.00
16	B_g	1232	1138	0.00
17	B_g	260	240	0.00
18	B_u	3949	3648	77.47
19	B_u	3141	2901	94.33
20	B_u	1634	1509	7.19
21	B_u	1491	1377	15.64
22	B_u	1254	1158	152.06
23	B_u	1162	1073	192.48
24	B_u	310	286	24.87

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.755	0.000
C2	0.000	-0.755	0.000
O3	1.354	-1.163	0.000
O4	-1.354	1.163	0.000
H5	1.386	-2.122	0.000
H6	-1.386	2.122	0.000
H7	-0.532	-1.114	0.885
H8	-0.532	-1.114	-0.885
H9	0.532	1.114	0.885
H10	0.532	1.114	-0.885

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5100	2.3479	1.4141	3.1936	1.9467	2.1347	2.1347	1.0926	1.0926
C2	1.5100		1.4141	2.3479	1.9467	3.1936	1.0926	1.0926	2.1347	2.1347
O3	2.3479	1.4141		3.5699	0.9597	4.2778	2.0834	2.0834	2.5773	2.5773
O4	1.4141	2.3479	3.5699		4.2778	0.9597	2.5773	2.5773	2.0834	2.0834
H5	3.1936	1.9467	0.9597	4.2778		5.0692	2.3401	2.3401	3.4617	3.4617
H6	1.9467	3.1936	4.2778	0.9597	5.0692		3.4617	3.4617	2.3401	2.3401
H7	2.1347	1.0926	2.0834	2.5773	2.3401	3.4617		1.7693	2.4680	3.0366
H8	2.1347	1.0926	2.0834	2.5773	2.3401	3.4617	1.7693		3.0366	2.4680
H9	1.0926	2.1347	2.5773	2.0834	3.4617	2.3401	2.4680	3.0366		1.7693
H10	1.0926	2.1347	2.5773	2.0834	3.4617	2.3401	3.0366	2.4680	1.7693

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.775	C1	C2	H7	109.158
C1	C2	H8	109.158	C1	O4	H6	108.662
C2	C1	O4	106.775	C2	C1	H9	109.158
C2	C1	H10	109.158	C2	O3	H5	108.662
O3	C2	H7	111.787	O3	C2	H8	111.787
O4	C1	H9	111.787	O4	C1	H10	111.787
H7	C2	H8	108.125	H9	C1	H10	108.125

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

using model chemistry: CID/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: CID/6-31G*

States and conformations

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