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	hartrees
Energy at 0K	-154.675422
Energy at 298.15K	-154.682162
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3176	3003	22.87
2	A₁	3039	2874	41.78
3	A₁	1556	1471	0.98
4	A₁	1528	1445	0.02
5	A₁	1305	1234	6.14
6	A₁	985	932	29.96
7	A₁	430	407	2.54
8	A₂	3088	2920	0.00
9	A₂	1518	1435	0.00
10	A₂	1192	1127	0.00
11	A₂	216	204	0.00
12	B₁	3085	2917	109.53
13	B₁	1529	1445	10.03
14	B₁	1228	1161	6.91
15	B₁	267	252	5.69
16	B₂	3174	3001	27.04
17	B₂	3029	2864	42.25
18	B₂	1536	1452	11.17
19	B₂	1494	1413	6.56
20	B₂	1245	1177	109.24
21	B₂	1154	1091	21.44

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.592
C2	0.000	1.159	-0.195
C3	0.000	-1.159	-0.195
H4	0.000	2.014	0.481
H5	0.000	-2.014	0.481
H6	0.889	1.218	-0.839
H7	-0.889	1.218	-0.839
H8	-0.889	-1.218	-0.839
H9	0.889	-1.218	-0.839

	O1	C2	C3	H4	H5	H6	H7	H8	H9
O1		1.4015	1.4015	2.0172	2.0172	2.0791	2.0791	2.0791	2.0791
C2	1.4015		2.3182	1.0906	3.2447	1.0993	1.0993	2.6183	2.6183
C3	1.4015	2.3182		3.2447	1.0906	2.6183	2.6183	1.0993	1.0993
H4	2.0172	1.0906	3.2447		4.0283	1.7800	1.7800	3.6029	3.6029
H5	2.0172	3.2447	1.0906	4.0283		3.6029	3.6029	1.7800	1.7800
H6	2.0791	1.0993	2.6183	1.7800	3.6029		1.7789	3.0163	2.4358
H7	2.0791	1.0993	2.6183	1.7800	3.6029	1.7789		2.4358	3.0163
H8	2.0791	2.6183	1.0993	3.6029	1.7800	3.0163	2.4358		1.7789
H9	2.0791	2.6183	1.0993	3.6029	1.7800	2.4358	3.0163	1.7789

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.430	O1	C2	H6	111.913
O1	C2	H7	111.913	O1	C3	H5	107.430
O1	C3	H8	111.913	O1	C3	H9	111.913
C2	O1	C3	111.599	H4	C2	H6	108.743
H4	C2	H7	108.743	H5	C3	H8	108.743
H5	C3	H9	108.743	H6	C2	H7	108.016
H8	C3	H9	108.016

All results from a given calculation for CH₃OCH₃ (Dimethyl ether)

using model chemistry: CCSD/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 CH3OCH3 (Dimethyl ether)

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

States and conformations

All results from a given calculation for CH₃OCH₃ (Dimethyl ether)