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	hartrees
Energy at 0K	-193.951554
Energy at 298.15K	-193.960556
HF Energy	-193.179387
Nuclear repulsion energy	134.128454

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3180	3019	24.84
2	A'	3179	3018	16.51
3	A'	3087	2931	14.07
4	A'	3024	2872	71.09
5	A'	3011	2859	37.78
6	A'	1547	1469	1.69
7	A'	1527	1450	4.61
8	A'	1517	1440	4.78
9	A'	1487	1412	0.27
10	A'	1434	1362	32.59
11	A'	1400	1329	0.95
12	A'	1248	1185	44.89
13	A'	1182	1122	128.49
14	A'	1127	1070	3.30
15	A'	1057	1004	18.56
16	A'	881	836	10.40
17	A'	470	446	0.63
18	A'	290	275	2.58
19	A"	3184	3023	19.19
20	A"	3088	2932	46.31
21	A"	3052	2897	59.19
22	A"	1507	1431	7.64
23	A"	1500	1424	4.66
24	A"	1310	1244	2.00
25	A"	1210	1149	9.51
26	A"	1178	1119	0.08
27	A"	828	786	0.19
28	A"	266	253	2.14
29	A"	216	205	1.02
30	A"	117	111	2.28

Atom	x (Å)	y (Å)	z (Å)
C1	1.318	1.221	0.000
O2	0.002	0.718	0.000
C3	0.000	-0.695	0.000
C4	-1.434	-1.167	0.000
H5	1.255	2.305	0.000
H6	1.870	0.895	0.888
H7	1.870	0.895	-0.888
H8	0.532	-1.070	-0.883
H9	0.532	-1.070	0.883
H10	-1.477	-2.254	0.000
H11	-1.952	-0.797	0.882
H12	-1.952	-0.797	-0.882

	C1	O2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.4089	2.3259	3.6439	1.0859	1.0946	1.0946	2.5779	2.5779	4.4601	3.9425	3.9425
O2	1.4089		1.4130	2.3696	2.0218	2.0756	2.0756	2.0627	2.0627	3.3200	2.6251	2.6251
C3	2.3259	1.4130		1.5099	3.2520	2.6106	2.6106	1.0969	1.0969	2.1478	2.1442	2.1442
C4	3.6439	2.3696	1.5099		4.3913	3.9950	3.9950	2.1576	2.1576	1.0885	1.0875	1.0875
H5	1.0859	2.0218	3.2520	4.3913		1.7757	1.7757	3.5624	3.5624	5.3152	4.5478	4.5478
H6	1.0946	2.0756	2.6106	3.9950	1.7757		1.7751	2.9647	2.3775	4.6812	4.1798	4.5391
H7	1.0946	2.0756	2.6106	3.9950	1.7757	1.7751		2.3775	2.9647	4.6812	4.5391	4.1798
H8	2.5779	2.0627	1.0969	2.1576	3.5624	2.9647	2.3775		1.7670	2.4940	3.0592	2.4980
H9	2.5779	2.0627	1.0969	2.1576	3.5624	2.3775	2.9647	1.7670		2.4940	2.4980	3.0592
H10	4.4601	3.3200	2.1478	1.0885	5.3152	4.6812	4.6812	2.4940	2.4940		1.7683	1.7683
H11	3.9425	2.6251	2.1442	1.0875	4.5478	4.1798	4.5391	3.0592	2.4980	1.7683		1.7648
H12	3.9425	2.6251	2.1442	1.0875	4.5478	4.5391	4.1798	2.4980	3.0592	1.7683	1.7648

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	C3	111.019	O2	C1	H5	107.572
O2	C1	H6	111.389	O2	C1	H7	111.389
O2	C3	C4	108.285	O2	C3	H8	109.899
O2	C3	H9	109.899	C3	C4	H10	110.448
C3	C4	H11	110.225	C3	C4	H12	110.225
C4	C3	H8	110.724	C4	C3	H9	110.724
H5	C1	H6	109.045	H5	C1	H7	109.045
H6	C1	H7	108.353	H8	C3	H9	107.310
H10	C4	H11	108.711	H10	C4	H12	108.711
H11	C4	H12	108.469

All results from a given calculation for CH₃OC₂H₅ (Ethane, methoxy-)

using model chemistry: MP2/cc-pVTZ

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 CH3OC2H5 (Ethane, methoxy-)

using model chemistry: MP2/cc-pVTZ

States and conformations

All results from a given calculation for CH₃OC₂H₅ (Ethane, methoxy-)