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	hartrees
Energy at 0K	-229.576389
Energy at 298.15K	-229.583637
HF Energy	-228.920476
Nuclear repulsion energy	130.426656

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3834	3597	0.00
2	A_g	3075	2885	0.00
3	A_g	1592	1494	0.00
4	A_g	1551	1455	0.00
5	A_g	1343	1260	0.00
6	A_g	1143	1072	0.00
7	A_g	1035	971	0.00
8	A_g	493	462	0.00
9	A_u	3134	2940	104.52
10	A_u	1266	1188	3.04
11	A_u	859	806	3.80
12	A_u	269	253	281.73
13	A_u	137	129	24.80
14	B_g	3109	2917	0.00
15	B_g	1345	1262	0.00
16	B_g	1204	1130	0.00
17	B_g	265	248	0.00
18	B_u	3835	3598	55.51
19	B_u	3079	2889	86.76
20	B_u	1601	1502	6.26
21	B_u	1458	1368	15.78
22	B_u	1234	1158	132.67
23	B_u	1131	1062	180.86
24	B_u	304	285	24.47

Atom	x (Å)	y (Å)	z (Å)
C1	0.437	0.618	0.000
C2	-0.437	-0.618	0.000
O3	0.437	-1.735	0.000
O4	-0.437	1.735	0.000
H5	-0.094	-2.541	0.000
H6	0.094	2.541	0.000
H7	-1.083	-0.593	0.889
H8	-1.083	-0.593	-0.889
H9	1.083	0.593	0.889
H10	1.083	0.593	-0.889

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5134	2.3522	1.4185	3.2029	1.9537	2.1369	2.1369	1.0989	1.0989
C2	1.5134		1.4185	2.3522	1.9537	3.2029	1.0989	1.0989	2.1369	2.1369
O3	2.3522	1.4185		3.5777	0.9656	4.2893	2.0983	2.0983	2.5741	2.5741
O4	1.4185	2.3522	3.5777		4.2893	0.9656	2.5741	2.5741	2.0983	2.0983
H5	3.2029	1.9537	0.9656	4.2893		5.0853	2.3581	2.3581	3.4638	3.4638
H6	1.9537	3.2029	4.2893	0.9656	5.0853		3.4638	3.4638	2.3581	2.3581
H7	2.1369	1.0989	2.0983	2.5741	2.3581	3.4638		1.7780	2.4691	3.0426
H8	2.1369	1.0989	2.0983	2.5741	2.3581	3.4638	1.7780		3.0426	2.4691
H9	1.0989	2.1369	2.5741	2.0983	3.4638	2.3581	2.4691	3.0426		1.7780
H10	1.0989	2.1369	2.5741	2.0983	3.4638	2.3581	3.0426	2.4691	1.7780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.651	C1	C2	H7	108.741
C1	C2	H8	108.741	C1	O4	H6	108.564
C2	C1	O4	106.651	C2	C1	H9	108.741
C2	C1	H10	108.741	C2	O3	H5	108.564
O3	C2	H7	112.302	O3	C2	H8	112.302
O4	C1	H9	112.302	O4	C1	H10	112.302
H7	C2	H8	108.002	H9	C1	H10	108.002

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

using model chemistry: MP3=FULL/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: MP3=FULL/6-31G*

States and conformations

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