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	hartrees
Energy at 0K	-229.484172
Energy at 298.15K	-229.491454
HF Energy	-228.921625
Nuclear repulsion energy	130.946515

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3943	3650	0.00
2	A_g	3135	2902	0.00
3	A_g	1624	1504	0.00
4	A_g	1585	1467	0.00
5	A_g	1364	1263	0.00
6	A_g	1168	1081	0.00
7	A_g	1051	973	0.00
8	A_g	502	465	0.00
9	A_u	3192	2956	116.23
10	A_u	1296	1200	3.87
11	A_u	874	809	4.27
12	A_u	264	244	289.75
13	A_u	143	132	26.78
14	B_g	3166	2932	0.00
15	B_g	1374	1272	0.00
16	B_g	1230	1139	0.00
17	B_g	259	239	0.00
18	B_u	3942	3649	74.60
19	B_u	3137	2904	96.15
20	B_u	1633	1512	7.29
21	B_u	1489	1379	15.45
22	B_u	1252	1159	150.53
23	B_u	1158	1072	194.02
24	B_u	309	286	24.76

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.755	0.000
C2	0.000	-0.755	0.000
O3	1.355	-1.163	0.000
O4	-1.355	1.163	0.000
H5	1.386	-2.123	0.000
H6	-1.386	2.123	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		1.5102	2.3483	1.4148	3.1940	1.9470	2.1351	2.1351	1.0928	1.0928
C2	1.5102		1.4148	2.3483	1.9470	3.1940	1.0928	1.0928	2.1351	2.1351
O3	2.3483	1.4148		3.5709	0.9601	4.2786	2.0841	2.0841	2.5777	2.5777
O4	1.4148	2.3483	3.5709		4.2786	0.9601	2.5777	2.5777	2.0841	2.0841
H5	3.1940	1.9470	0.9601	4.2786		5.0700	2.3404	2.3404	3.4623	3.4623
H6	1.9470	3.1940	4.2786	0.9601	5.0700		3.4623	3.4623	2.3404	2.3404
H7	2.1351	1.0928	2.0841	2.5777	2.3404	3.4623		1.7697	2.4684	3.0373
H8	2.1351	1.0928	2.0841	2.5777	2.3404	3.4623	1.7697		3.0373	2.4684
H9	1.0928	2.1351	2.5777	2.0841	3.4623	2.3404	2.4684	3.0373		1.7697
H10	1.0928	2.1351	2.5777	2.0841	3.4623	2.3404	3.0373	2.4684	1.7697

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.758	C1	C2	H7	109.166
C1	C2	H8	109.166	C1	O4	H6	108.622
C2	C1	O4	106.758	C2	C1	H9	109.166
C2	C1	H10	109.166	C2	O3	H5	108.622
O3	C2	H7	111.786	O3	C2	H8	111.786
O4	C1	H9	111.786	O4	C1	H10	111.786
H7	C2	H8	108.128	H9	C1	H10	108.128

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

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

States and conformations

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