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	hartrees
Energy at 0K	-60.350616
Energy at 298.15K	-60.362016
Nuclear repulsion energy	143.281375

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3184	3048	0.00
2	A_g	3037	2908	0.00
3	A_g	3016	2888	0.00
4	A_g	1527	1462	0.00
5	A_g	1506	1442	0.00
6	A_g	1479	1417	0.00
7	A_g	1444	1383	0.00
8	A_g	1215	1163	0.00
9	A_g	1162	1113	0.00
10	A_g	1096	1049	0.00
11	A_g	979	938	0.00
12	A_g	380	364	0.00
13	A_g	306	293	0.00
14	A_u	3112	2980	131.47
15	A_u	3092	2961	207.60
16	A_u	1492	1429	22.10
17	A_u	1212	1160	11.96
18	A_u	1153	1104	0.41
19	A_u	839	803	0.26
20	A_u	220	211	12.78
21	A_u	96	92	20.71
22	A_u	68	65	4.55
23	B_g	3093	2961	0.00
24	B_g	3081	2950	0.00
25	B_g	1492	1428	0.00
26	B_g	1284	1230	0.00
27	B_g	1165	1115	0.00
28	B_g	1130	1082	0.00
29	B_g	208	199	0.00
30	B_g	117	112	0.00
31	B_u	3184	3048	90.92
32	B_u	3039	2910	142.98
33	B_u	3015	2886	164.46
34	B_u	1534	1469	7.67
35	B_u	1505	1441	26.20
36	B_u	1474	1411	0.24
37	B_u	1364	1306	9.34
38	B_u	1200	1149	117.76
39	B_u	1151	1102	155.45
40	B_u	925	885	46.80
41	B_u	471	451	5.96
42	B_u	134	129	8.60

Atom	x (Å)	y (Å)	z (Å)
O1	0.444	1.770	0.000
O2	-0.444	-1.770	0.000
C3	0.262	-3.030	0.000
C4	-0.262	3.030	0.000
C5	-0.444	0.624	0.000
C6	0.444	-0.624	0.000
H7	0.499	3.821	0.000
H8	-0.499	-3.821	0.000
H9	0.898	-3.135	0.900
H10	0.898	-3.135	-0.900
H11	-0.898	3.135	0.900
H12	-0.898	3.135	-0.900
H13	-1.092	0.627	0.897
H14	-1.092	0.627	-0.897
H15	1.092	-0.627	0.897
H16	1.092	-0.627	-0.897

	O1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
O1		3.6491	4.8030	1.4448	1.4501	2.3934	2.0520	5.6694	5.0073	5.0073	2.1160	2.1160	2.1150	2.1150	2.6393	2.6393
O2	3.6491		1.4448	4.8030	2.3934	1.4501	5.6694	2.0520	2.1160	2.1160	5.0073	5.0073	2.6393	2.6393	2.1150	2.1150
C3	4.8030	1.4448		6.0825	3.7214	2.4130	6.8549	1.0972	1.1073	1.1073	6.3375	6.3375	4.0011	4.0011	2.6965	2.6965
C4	1.4448	4.8030	6.0825		2.4130	3.7214	1.0972	6.8549	6.3375	6.3375	1.1073	1.1073	2.6965	2.6965	4.0011	4.0011
C5	1.4501	2.3934	3.7214	2.4130		1.5319	3.3332	4.4450	4.0918	4.0918	2.7061	2.7061	1.1066	1.1066	2.1749	2.1749
C6	2.3934	1.4501	2.4130	3.7214	1.5319		4.4450	3.3332	2.7061	2.7061	4.0918	4.0918	2.1749	2.1749	1.1066	1.1066
H7	2.0520	5.6694	6.8549	1.0972	3.3332	4.4450		7.7065	7.0254	7.0254	1.7975	1.7975	3.6796	3.6796	4.5756	4.5756
H8	5.6694	2.0520	1.0972	6.8549	4.4450	3.3332	7.7065		1.7975	1.7975	7.0254	7.0254	4.5756	4.5756	3.6796	3.6796
H9	5.0073	2.1160	1.1073	6.3375	4.0918	2.7061	7.0254	1.7975		1.8002	6.5225	6.7664	4.2559	4.6198	2.5162	3.0921
H10	5.0073	2.1160	1.1073	6.3375	4.0918	2.7061	7.0254	1.7975	1.8002		6.7664	6.5225	4.6198	4.2559	3.0921	2.5162
H11	2.1160	5.0073	6.3375	1.1073	2.7061	4.0918	1.7975	7.0254	6.5225	6.7664		1.8002	2.5162	3.0921	4.2559	4.6198
H12	2.1160	5.0073	6.3375	1.1073	2.7061	4.0918	1.7975	7.0254	6.7664	6.5225	1.8002		3.0921	2.5162	4.6198	4.2559
H13	2.1150	2.6393	4.0011	2.6965	1.1066	2.1749	3.6796	4.5756	4.2559	4.6198	2.5162	3.0921		1.7941	2.5186	3.0923
H14	2.1150	2.6393	4.0011	2.6965	1.1066	2.1749	3.6796	4.5756	4.6198	4.2559	3.0921	2.5162	1.7941		3.0923	2.5186
H15	2.6393	2.1150	2.6965	4.0011	2.1749	1.1066	4.5756	3.6796	2.5162	3.0921	4.2559	4.6198	2.5186	3.0923		1.7941
H16	2.6393	2.1150	2.6965	4.0011	2.1749	1.1066	4.5756	3.6796	3.0921	2.5162	4.6198	4.2559	3.0923	2.5186	1.7941

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	H7	106.855	O1	C4	H11	111.333
O1	C4	H12	111.333	O1	C5	C6	106.728
O1	C5	H13	110.914	O1	C5	H14	110.914
O2	C3	H8	106.855	O2	C3	H9	111.333
O2	C3	H10	111.333	O2	C6	C5	106.728
O2	C6	H15	110.914	O2	C6	H16	110.914
C3	O2	C6	112.931	C4	O1	C5	112.931
C5	C6	H15	109.983	C5	C6	H16	109.983
C6	C5	H13	109.983	C6	C5	H14	109.983
H7	C4	H11	109.253	H7	C4	H12	109.253
H8	C3	H9	109.253	H8	C3	H10	109.253
H9	C3	H10	108.767	H11	C4	H12	108.767
H13	C5	H14	108.320	H15	C6	H16	108.320

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

using model chemistry: B1B95/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	-0.265
2	O	-0.265
3	C	-0.347
4	C	-0.347
5	C	-0.163
6	C	-0.163
7	H	0.211
8	H	0.211
9	H	0.145
10	H	0.145
11	H	0.145
12	H	0.145
13	H	0.137
14	H	0.137
15	H	0.137
16	H	0.137

	x	y	z
x	6.161	-0.101	0.000
y	-0.101	9.084	0.000
z	0.000	0.000	5.953

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: B1B95/CEP-31G

States and conformations

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