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	hartrees
Energy at 0K	-228.074134
Energy at 298.15K	-228.081351
HF Energy	-227.649571
Nuclear repulsion energy	128.210872

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3533	3373	0.00
2	A_g	3071	2933	0.00
3	A_g	1632	1558	0.00
4	A_g	1524	1455	0.00
5	A_g	1325	1265	0.00
6	A_g	1035	989	0.00
7	A_g	996	951	0.00
8	A_g	465	444	0.00
9	A_u	3130	2988	111.46
10	A_u	1243	1187	1.67
11	A_u	897	857	3.45
12	A_u	282	269	317.02
13	A_u	138	132	9.51
14	B_g	3102	2962	0.00
15	B_g	1376	1314	0.00
16	B_g	1182	1128	0.00
17	B_g	280	268	0.00
18	B_u	3534	3374	3.25
19	B_u	3077	2938	68.02
20	B_u	1644	1570	5.26
21	B_u	1463	1397	3.34
22	B_u	1230	1175	106.08
23	B_u	1021	975	134.58
24	B_u	272	260	29.12

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.763	0.000
C2	0.000	-0.763	0.000
O3	1.422	-1.139	0.000
O4	-1.422	1.139	0.000
H5	1.471	-2.129	0.000
H6	-1.471	2.129	0.000
H7	-0.534	-1.116	0.890
H8	-0.534	-1.116	-0.890
H9	0.534	1.116	0.890
H10	0.534	1.116	-0.890

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5255	2.3747	1.4709	3.2444	2.0077	2.1462	2.1462	1.0964	1.0964
C2	1.5255		1.4709	2.3747	2.0077	3.2444	1.0964	1.0964	2.1462	2.1462
O3	2.3747	1.4709		3.6439	0.9910	4.3647	2.1493	2.1493	2.5815	2.5815
O4	1.4709	2.3747	3.6439		4.3647	0.9910	2.5815	2.5815	2.1493	2.1493
H5	3.2444	2.0077	0.9910	4.3647		5.1756	2.4168	2.4168	3.4924	3.4924
H6	2.0077	3.2444	4.3647	0.9910	5.1756		3.4924	3.4924	2.4168	2.4168
H7	2.1462	1.0964	2.1493	2.5815	2.4168	3.4924		1.7797	2.4742	3.0478
H8	2.1462	1.0964	2.1493	2.5815	2.4168	3.4924	1.7797		3.0478	2.4742
H9	1.0964	2.1462	2.5815	2.1493	3.4924	2.4168	2.4742	3.0478		1.7797
H10	1.0964	2.1462	2.5815	2.1493	3.4924	2.4168	3.0478	2.4742	1.7797

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	104.830	C1	C2	H7	108.781
C1	C2	H8	108.781	C1	O4	H6	107.682
C2	C1	O4	104.830	C2	C1	H9	108.781
C2	C1	H10	108.781	C2	O3	H5	107.682
O3	C2	H7	112.881	O3	C2	H8	112.881
O4	C1	H9	112.881	O4	C1	H10	112.881
H7	C2	H8	108.509	H9	C1	H10	108.509

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

using model chemistry: MP2=FULL/3-21G

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=FULL/3-21G

States and conformations

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