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	hartrees
Energy at 0K	-308.109214
Energy at 298.15K	-308.120974
HF Energy	-307.013862
Nuclear repulsion energy	253.875901

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3205	3027	0.00
2	A_g	3054	2884	0.00
3	A_g	3044	2875	0.00
4	A_g	1558	1472	0.00
5	A_g	1538	1452	0.00
6	A_g	1510	1426	0.00
7	A_g	1464	1383	0.00
8	A_g	1264	1194	0.00
9	A_g	1199	1133	0.00
10	A_g	1109	1048	0.00
11	A_g	1046	988	0.00
12	A_g	404	382	0.00
13	A_g	341	322	0.00
14	A_u	3121	2948	50.19
15	A_u	3110	2938	113.90
16	A_u	1521	1437	11.89
17	A_u	1255	1185	12.23
18	A_u	1200	1133	1.99
19	A_u	848	800	0.21
20	A_u	257	243	7.54
21	A_u	107	101	6.49
22	A_u	73	69	3.64
23	B_g	3121	2948	0.00
24	B_g	3087	2915	0.00
25	B_g	1521	1437	0.00
26	B_g	1311	1238	0.00
27	B_g	1217	1149	0.00
28	B_g	1176	1111	0.00
29	B_g	241	228	0.00
30	B_g	130	123	0.00
31	B_u	3205	3027	40.86
32	B_u	3054	2885	105.56
33	B_u	3047	2878	52.57
34	B_u	1565	1478	2.62
35	B_u	1539	1454	19.48
36	B_u	1503	1420	4.66
37	B_u	1376	1300	26.52
38	B_u	1245	1176	164.56
39	B_u	1195	1129	183.29
40	B_u	997	942	53.78
41	B_u	513	484	4.03
42	B_u	145	137	3.99

Atom	x (Å)	y (Å)	z (Å)
O1	1.345	1.171	0.000
O2	-1.345	-1.171	0.000
C3	-1.442	-2.576	0.000
C4	1.442	2.576	0.000
C5	0.000	0.757	0.000
C6	0.000	-0.757	0.000
H7	2.501	2.829	0.000
H8	-2.501	-2.829	0.000
H9	-0.969	-3.012	0.889
H10	-0.969	-3.012	-0.889
H11	0.969	3.012	0.889
H12	0.969	3.012	-0.889
H13	-0.532	1.127	0.887
H14	-0.532	1.127	-0.887
H15	0.532	-1.127	0.887
H16	0.532	-1.127	-0.887

	O1	O2	C3	C4	C5	C6	H7	H8	H9	H10	H11	H12	H13	H14	H15	H16
O1		3.5663	4.6693	1.4078	1.4070	2.3505	2.0213	5.5489	4.8623	4.8623	2.0782	2.0782	2.0765	2.0765	2.5935	2.5935
O2	3.5663		1.4078	4.6693	2.3505	1.4070	5.5489	2.0213	2.0782	2.0782	4.8623	4.8623	2.5935	2.5935	2.0765	2.0765
C3	4.6693	1.4078		5.9034	3.6309	2.3209	6.6900	1.0892	1.0972	1.0972	6.1500	6.1500	3.9141	3.9141	2.6047	2.6047
C4	1.4078	4.6693	5.9034		2.3209	3.6309	1.0892	6.6900	6.1500	6.1500	1.0972	1.0972	2.6047	2.6047	3.9141	3.9141
C5	1.4070	2.3505	3.6309	2.3209		1.5137	3.2480	4.3719	3.9915	3.9915	2.6105	2.6105	1.0988	1.0988	2.1489	2.1489
C6	2.3505	1.4070	2.3209	3.6309	1.5137		4.3719	3.2480	2.6105	2.6105	3.9915	3.9915	2.1489	2.1489	1.0988	1.0988
H7	2.0213	5.5489	6.6900	1.0892	3.2480	4.3719		7.5521	6.8519	6.8519	1.7805	1.7805	3.5899	3.5899	4.5066	4.5066
H8	5.5489	2.0213	1.0892	6.6900	4.3719	3.2480	7.5521		1.7805	1.7805	6.8519	6.8519	4.5066	4.5066	3.5899	3.5899
H9	4.8623	2.0782	1.0972	6.1500	3.9915	2.6105	6.8519	1.7805		1.7778	6.3279	6.5729	4.1614	4.5246	2.4102	2.9940
H10	4.8623	2.0782	1.0972	6.1500	3.9915	2.6105	6.8519	1.7805	1.7778		6.5729	6.3279	4.5246	4.1614	2.9940	2.4102
H11	2.0782	4.8623	6.1500	1.0972	2.6105	3.9915	1.7805	6.8519	6.3279	6.5729		1.7778	2.4102	2.9940	4.1614	4.5246
H12	2.0782	4.8623	6.1500	1.0972	2.6105	3.9915	1.7805	6.8519	6.5729	6.3279	1.7778		2.9940	2.4102	4.5246	4.1614
H13	2.0765	2.5935	3.9141	2.6047	1.0988	2.1489	3.5899	4.5066	4.1614	4.5246	2.4102	2.9940		1.7745	2.4920	3.0592
H14	2.0765	2.5935	3.9141	2.6047	1.0988	2.1489	3.5899	4.5066	4.5246	4.1614	2.9940	2.4102	1.7745		3.0592	2.4920
H15	2.5935	2.0765	2.6047	3.9141	2.1489	1.0988	4.5066	3.5899	2.4102	2.9940	4.1614	4.5246	2.4920	3.0592		1.7745
H16	2.5935	2.0765	2.6047	3.9141	2.1489	1.0988	4.5066	3.5899	2.9940	2.4102	4.5246	4.1614	3.0592	2.4920	1.7745

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	H7	107.412	O1	C4	H11	111.525
O1	C4	H12	111.525	O1	C5	C6	107.125
O1	C5	H13	111.340	O1	C5	H14	111.340
O2	C3	H8	107.412	O2	C3	H9	111.525
O2	C3	H10	111.525	O2	C6	C5	107.125
O2	C6	H15	111.340	O2	C6	H16	111.340
C3	O2	C6	111.088	C4	O1	C5	111.088
C5	C6	H15	109.663	C5	C6	H16	109.663
C6	C5	H13	109.663	C6	C5	H14	109.663
H7	C4	H11	109.051	H7	C4	H12	109.051
H8	C3	H9	109.051	H8	C3	H10	109.051
H9	C3	H10	108.228	H11	C4	H12	108.228
H13	C5	H14	107.706	H15	C6	H16	107.706

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

using model chemistry: MP2/6-31G(2df,p)

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 C4H10O2 (Ethane, 1,2-dimethoxy-)

using model chemistry: MP2/6-31G(2df,p)

States and conformations

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