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	hartrees
Energy at 0K	-229.631742
Energy at 298.15K	-229.638695
HF Energy	-228.950334
Nuclear repulsion energy	130.339474

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3897	3660	0.00
2	A_g	3111	2922	0.00
3	A_g	1576	1480	0.00
4	A_g	1514	1422	0.00
5	A_g	1294	1216	0.00
6	A_g	1101	1034	0.00
7	A_g	1016	954	0.00
8	A_g	486	456	0.00
9	A_u	3187	2994	69.66
10	A_u	1246	1171	1.52
11	A_u	852	801	2.24
12	A_u	210	198	213.71
13	A_u	96	90	101.08
14	B_g	3163	2971	0.00
15	B_g	1331	1250	0.00
16	B_g	1186	1114	0.00
17	B_g	180	169	0.00
18	B_u	3898	3661	84.97
19	B_u	3116	2926	90.36
20	B_u	1583	1487	6.08
21	B_u	1418	1331	4.82
22	B_u	1189	1117	90.09
23	B_u	1081	1016	222.68
24	B_u	299	281	25.33

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.755	0.000
C2	0.000	-0.755	0.000
O3	1.372	-1.157	0.000
O4	-1.372	1.157	0.000
H5	1.413	-2.120	0.000
H6	-1.413	2.120	0.000
H7	-0.522	-1.117	0.888
H8	-0.522	-1.117	-0.888
H9	0.522	1.117	0.888
H10	0.522	1.117	-0.888

	C1	C2	O3	O4	H5	H6	H7	H8	H9	H10
C1		1.5100	2.3533	1.4300	3.2032	1.9644	2.1366	2.1366	1.0916	1.0916
C2	1.5100		1.4300	2.3533	1.9644	3.2032	1.0916	1.0916	2.1366	2.1366
O3	2.3533	1.4300		3.5896	0.9641	4.3003	2.0922	2.0922	2.5849	2.5849
O4	1.4300	2.3533	3.5896		4.3003	0.9641	2.5849	2.5849	2.0922	2.0922
H5	3.2032	1.9644	0.9641	4.3003		5.0950	2.3529	2.3529	3.4727	3.4727
H6	1.9644	3.2032	4.3003	0.9641	5.0950		3.4727	3.4727	2.3529	2.3529
H7	2.1366	1.0916	2.0922	2.5849	2.3529	3.4727		1.7759	2.4656	3.0385
H8	2.1366	1.0916	2.0922	2.5849	2.3529	3.4727	1.7759		3.0385	2.4656
H9	1.0916	2.1366	2.5849	2.0922	3.4727	2.3529	2.4656	3.0385		1.7759
H10	1.0916	2.1366	2.5849	2.0922	3.4727	2.3529	3.0385	2.4656	1.7759

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.308	C1	C2	H7	109.369
C1	C2	H8	109.369	C1	O4	H6	108.711
C2	C1	O4	106.308	C2	C1	H9	109.369
C2	C1	H10	109.369	C2	O3	H5	108.711
O3	C2	H7	111.435	O3	C2	H8	111.435
O4	C1	H9	111.435	O4	C1	H10	111.435
H7	C2	H8	108.870	H9	C1	H10	108.870

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

using model chemistry: MP2=FULL/6-31+G**

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/6-31+G**

States and conformations

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