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	hartrees
Energy at 0K	-308.693138
Energy at 298.15K	-308.704618
HF Energy	-308.693138
Nuclear repulsion energy	250.987339

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3082	3029	0.00
2	A_g	2929	2878	0.00
3	A_g	2917	2867	0.00
4	A_g	1498	1472	0.00
5	A_g	1476	1450	0.00
6	A_g	1453	1428	0.00
7	A_g	1413	1388	0.00
8	A_g	1207	1187	0.00
9	A_g	1121	1102	0.00
10	A_g	1055	1037	0.00
11	A_g	982	965	0.00
12	A_g	387	380	0.00
13	A_g	327	321	0.00
14	A_u	2978	2927	22.72
15	A_u	2972	2921	257.30
16	A_u	1460	1434	13.58
17	A_u	1209	1189	12.90
18	A_u	1150	1130	3.23
19	A_u	821	806	0.39
20	A_u	238	234	8.70
21	A_u	90	88	8.46
22	A_u	62	61	3.83
23	B_g	2973	2922	0.00
24	B_g	2950	2900	0.00
25	B_g	1460	1434	0.00
26	B_g	1270	1249	0.00
27	B_g	1163	1143	0.00
28	B_g	1124	1104	0.00
29	B_g	225	221	0.00
30	B_g	119	117	0.00
31	B_u	3082	3029	69.00
32	B_u	2931	2881	186.10
33	B_u	2918	2867	114.36
34	B_u	1504	1478	2.17
35	B_u	1477	1451	22.03
36	B_u	1448	1423	3.38
37	B_u	1335	1312	25.32
38	B_u	1186	1165	67.78
39	B_u	1123	1103	333.46
40	B_u	929	913	67.71
41	B_u	498	490	3.12
42	B_u	145	142	3.99

Atom	x (Å)	y (Å)	z (Å)
O1	0.435	1.753	0.000
O2	-0.435	-1.753	0.000
C3	0.275	-2.985	0.000
C4	-0.275	2.985	0.000
C5	-0.435	0.626	0.000
C6	0.435	-0.626	0.000
H7	0.473	3.786	0.000
H8	-0.473	-3.786	0.000
H9	0.913	-3.083	0.898
H10	0.913	-3.083	-0.898
H11	-0.913	3.083	0.898
H12	-0.913	3.083	-0.898
H13	-1.086	0.632	0.894
H14	-1.086	0.632	-0.894
H15	1.086	-0.632	0.894
H16	1.086	-0.632	-0.894

	O1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
O1		3.6131	4.7408	1.4214	1.4239	2.3798	2.0326	5.6130	4.9422	4.9422	2.0955	2.0955	2.0907	2.0907	2.6291	2.6291
O2	3.6131		1.4214	4.7408	2.3798	1.4239	5.6130	2.0326	2.0955	2.0955	4.9422	4.9422	2.6291	2.6291	2.0907	2.0907
C3	4.7408	1.4214		5.9948	3.6803	2.3638	6.7732	1.0962	1.1057	1.1057	6.2478	6.2478	3.9662	3.9662	2.6445	2.6445
C4	1.4214	4.7408	5.9948		2.3638	3.6803	1.0962	6.7732	6.2478	6.2478	1.1057	1.1057	2.6445	2.6445	3.9662	3.9662
C5	1.4239	2.3798	3.6803	2.3638		1.5254	3.2873	4.4121	4.0475	4.0475	2.6588	2.6588	1.1060	1.1060	2.1671	2.1671
C6	2.3798	1.4239	2.3638	3.6803	1.5254		4.4121	3.2873	2.6588	2.6588	4.0475	4.0475	2.1671	2.1671	1.1060	1.1060
H7	2.0326	5.6130	6.7732	1.0962	3.2873	4.4121		7.6302	6.9410	6.9410	1.7948	1.7948	3.6301	3.6301	4.5484	4.5484
H8	5.6130	2.0326	1.0962	6.7732	4.4121	3.2873	7.6302		1.7948	1.7948	6.9410	6.9410	4.5484	4.5484	3.6301	3.6301
H9	4.9422	2.0955	1.1057	6.2478	4.0475	2.6588	6.9410	1.7948		1.7956	6.4306	6.6766	4.2184	4.5832	2.4573	3.0413
H10	4.9422	2.0955	1.1057	6.2478	4.0475	2.6588	6.9410	1.7948	1.7956		6.6766	6.4306	4.5832	4.2184	3.0413	2.4573
H11	2.0955	4.9422	6.2478	1.1057	2.6588	4.0475	1.7948	6.9410	6.4306	6.6766		1.7956	2.4573	3.0413	4.2184	4.5832
H12	2.0955	4.9422	6.2478	1.1057	2.6588	4.0475	1.7948	6.9410	6.6766	6.4306	1.7956		3.0413	2.4573	4.5832	4.2184
H13	2.0907	2.6291	3.9662	2.6445	1.1060	2.1671	3.6301	4.5484	4.2184	4.5832	2.4573	3.0413		1.7884	2.5127	3.0841
H14	2.0907	2.6291	3.9662	2.6445	1.1060	2.1671	3.6301	4.5484	4.5832	4.2184	3.0413	2.4573	1.7884		3.0841	2.5127
H15	2.6291	2.0907	2.6445	3.9662	2.1671	1.1060	4.5484	3.6301	2.4573	3.0413	4.2184	4.5832	2.5127	3.0841		1.7884
H16	2.6291	2.0907	2.6445	3.9662	2.1671	1.1060	4.5484	3.6301	3.0413	2.4573	4.5832	4.2184	3.0841	2.5127	1.7884

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	H7	107.352	O1	C4	H11	111.419
O1	C4	H12	111.419	O1	C5	C6	108.202
O1	C5	H13	110.693	O1	C5	H14	110.693
O2	C3	H8	107.352	O2	C3	H9	111.419
O2	C3	H10	111.419	O2	C6	C5	108.202
O2	C6	H15	110.693	O2	C6	H16	110.693
C3	O2	C6	112.939	C4	O1	C5	112.939
C5	C6	H15	109.795	C5	C6	H16	109.795
C6	C5	H13	109.795	C6	C5	H14	109.795
H7	C4	H11	109.074	H7	C4	H12	109.074
H8	C3	H9	109.074	H8	C3	H10	109.074
H9	C3	H10	108.454	H11	C4	H12	108.454
H13	C5	H14	107.663	H15	C6	H16	107.663

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

using model chemistry: B97D3/6-31+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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Number	Element	Mulliken
1	O	-0.313
2	O	-0.313
3	C	-0.221
4	C	-0.221
5	C	-0.159
6	C	-0.159
7	H	0.152
8	H	0.152
9	H	0.132
10	H	0.132
11	H	0.132
12	H	0.132
13	H	0.139
14	H	0.139
15	H	0.139
16	H	0.139

	x	y	z
x	8.195	-0.233	0.000
y	-0.233	11.162	0.000
z	0.000	0.000	7.843

<r²>	273.360
(<r²>)^1/2	16.534

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

using model chemistry: B97D3/6-31+G**

States and conformations

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