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	hartrees
Energy at 0K	-59.133071
Energy at 298.15K	-59.145004
Nuclear repulsion energy	146.111708

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3317	2978	0.00
2	A_g	3215	2887	0.00
3	A_g	3190	2865	0.00
4	A_g	1658	1489	0.00
5	A_g	1642	1475	0.00
6	A_g	1628	1462	0.00
7	A_g	1593	1431	0.00
8	A_g	1365	1226	0.00
9	A_g	1289	1158	0.00
10	A_g	1167	1048	0.00
11	A_g	1118	1004	0.00
12	A_g	421	378	0.00
13	A_g	356	319	0.00
14	A_u	3268	2934	215.32
15	A_u	3243	2912	181.12
16	A_u	1626	1460	8.98
17	A_u	1356	1218	20.84
18	A_u	1285	1154	7.32
19	A_u	884	793	1.42
20	A_u	254	228	13.08
21	A_u	120	108	9.76
22	A_u	75	67	5.88
23	B_g	3243	2913	0.00
24	B_g	3239	2908	0.00
25	B_g	1626	1460	0.00
26	B_g	1415	1270	0.00
27	B_g	1296	1164	0.00
28	B_g	1248	1121	0.00
29	B_g	234	211	0.00
30	B_g	130	117	0.00
31	B_u	3317	2978	150.92
32	B_u	3214	2886	191.09
33	B_u	3189	2863	144.84
34	B_u	1664	1494	3.26
35	B_u	1635	1469	18.81
36	B_u	1613	1448	17.27
37	B_u	1489	1337	68.52
38	B_u	1347	1210	287.43
39	B_u	1278	1147	267.00
40	B_u	1064	955	83.34
41	B_u	539	484	4.45
42	B_u	157	141	5.17

Atom	x (Å)	y (Å)	z (Å)
O1	1.338	1.193	0.000
O2	-1.338	-1.193	0.000
C3	-1.474	-2.588	0.000
C4	1.474	2.588	0.000
C5	0.000	0.764	0.000
C6	0.000	-0.764	0.000
H7	2.537	2.816	0.000
H8	-2.537	-2.816	0.000
H9	-1.013	-3.031	0.889
H10	-1.013	-3.031	-0.889
H11	1.013	3.031	0.889
H12	1.013	3.031	-0.889
H13	-0.526	1.134	0.885
H14	-0.526	1.134	-0.885
H15	0.526	-1.134	0.885
H16	0.526	-1.134	-0.885

	O1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
O1		3.5857	4.7120	1.4016	1.4055	2.3705	2.0175	5.5757	4.9151	4.9151	2.0676	2.0676	2.0648	2.0648	2.6182	2.6182
O2	3.5857		1.4016	4.7120	2.3705	1.4055	5.5757	2.0175	2.0676	2.0676	4.9151	4.9151	2.6182	2.6182	2.0648	2.0648
C3	4.7120	1.4016		5.9563	3.6613	2.3452	6.7295	1.0873	1.0952	1.0952	6.2084	6.2084	3.9408	3.9408	2.6264	2.6264
C4	1.4016	4.7120	5.9563		2.3452	3.6613	1.0873	6.7295	6.2084	6.2084	1.0952	1.0952	2.6264	2.6264	3.9408	3.9408
C5	1.4055	2.3705	3.6613	2.3452		1.5273	3.2630	4.3873	4.0268	4.0268	2.6375	2.6375	1.0939	1.0939	2.1585	2.1585
C6	2.3705	1.4055	2.3452	3.6613	1.5273		4.3873	3.2630	2.6375	2.6375	4.0268	4.0268	2.1585	2.1585	1.0939	1.0939
H7	2.0175	5.5757	6.7295	1.0873	3.2630	4.3873		7.5802	6.8974	6.8974	1.7777	1.7777	3.6050	3.6050	4.5192	4.5192
H8	5.5757	2.0175	1.0873	6.7295	4.3873	3.2630	7.5802		1.7777	1.7777	6.8974	6.8974	4.5192	4.5192	3.6050	3.6050
H9	4.9151	2.0676	1.0952	6.2084	4.0268	2.6375	6.8974	1.7777		1.7785	6.3912	6.6340	4.1927	4.5526	2.4430	3.0192
H10	4.9151	2.0676	1.0952	6.2084	4.0268	2.6375	6.8974	1.7777	1.7785		6.6340	6.3912	4.5526	4.1927	3.0192	2.4430
H11	2.0676	4.9151	6.2084	1.0952	2.6375	4.0268	1.7777	6.8974	6.3912	6.6340		1.7785	2.4430	3.0192	4.1927	4.5526
H12	2.0676	4.9151	6.2084	1.0952	2.6375	4.0268	1.7777	6.8974	6.6340	6.3912	1.7785		3.0192	2.4430	4.5526	4.1927
H13	2.0648	2.6182	3.9408	2.6264	1.0939	2.1585	3.6050	4.5192	4.1927	4.5526	2.4430	3.0192		1.7698	2.4994	3.0625
H14	2.0648	2.6182	3.9408	2.6264	1.0939	2.1585	3.6050	4.5192	4.5526	4.1927	3.0192	2.4430	1.7698		3.0625	2.4994
H15	2.6182	2.0648	2.6264	3.9408	2.1585	1.0939	4.5192	3.6050	2.4430	3.0192	4.1927	4.5526	2.4994	3.0625		1.7698
H16	2.6182	2.0648	2.6264	3.9408	2.1585	1.0939	4.5192	3.6050	3.0192	2.4430	4.5526	4.1927	3.0625	2.4994	1.7698

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	H7	107.637	O1	C4	H11	111.215
O1	C4	H12	111.215	O1	C5	C6	107.781
O1	C5	H13	110.781	O1	C5	H14	110.781
O2	C3	H8	107.637	O2	C3	H9	111.215
O2	C3	H10	111.215	O2	C6	C5	107.781
O2	C6	H15	110.781	O2	C6	H16	110.781
C3	O2	C6	113.321	C4	O1	C5	113.321
C5	C6	H15	109.760	C5	C6	H16	109.760
C6	C5	H13	109.760	C6	C5	H14	109.760
H7	C4	H11	109.078	H7	C4	H12	109.078
H8	C3	H9	109.078	H8	C3	H10	109.078
H9	C3	H10	108.574	H11	C4	H12	108.574
H13	C5	H14	107.977	H15	C6	H16	107.977

All results from a given calculation for C₄H₁₀O₂ (Ethane, 1,2-dimethoxy-)

using model chemistry: HF/CEP-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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Number	Element	Mulliken
1	O	-0.348
2	O	-0.348
3	C	-0.216
4	C	-0.216
5	C	-0.021
6	C	-0.021
7	H	0.178
8	H	0.178
9	H	0.112
10	H	0.112
11	H	0.112
12	H	0.112
13	H	0.092
14	H	0.092
15	H	0.092
16	H	0.092

	x	y	z
x	6.725	1.087	0.000
y	1.087	7.691	0.000
z	0.000	0.000	5.982

<r²>	218.811
(<r²>)^1/2	14.792

All results from a given calculation for C4H10O2 (Ethane, 1,2-dimethoxy-)

using model chemistry: HF/CEP-31G*

States and conformations

All results from a given calculation for C₄H₁₀O₂ (Ethane, 1,2-dimethoxy-)