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	hartrees
Energy at 0K	-267.593234
Energy at 298.15K	-267.600082
HF Energy	-266.833200
Nuclear repulsion energy	181.222124

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3258	3070	13.19
2	A'	3253	3065	3.60
3	A'	3132	2951	24.41
4	A'	3130	2949	0.59
5	A'	1838	1732	179.72
6	A'	1561	1470	7.47
7	A'	1537	1448	14.62
8	A'	1522	1434	12.76
9	A'	1456	1372	60.02
10	A'	1325	1248	328.66
11	A'	1239	1167	2.11
12	A'	1111	1047	68.27
13	A'	1019	960	2.06
14	A'	877	826	20.71
15	A'	655	617	7.11
16	A'	430	406	6.10
17	A'	293	276	12.37
18	A"	3227	3041	17.66
19	A"	3217	3031	2.98
20	A"	1551	1461	6.35
21	A"	1538	1450	8.27
22	A"	1208	1138	1.11
23	A"	1099	1035	6.93
24	A"	611	576	6.19
25	A"	185	174	7.15
26	A"	157	148	0.57
27	A"	72	68	0.57

Atom	x (Å)	y (Å)	z (Å)
C1	1.134	1.463	0.000
C2	0.000	0.493	0.000
O3	-1.187	0.772	0.000
O4	0.487	-0.776	0.000
C5	-0.525	-1.781	0.000
H6	0.736	2.477	0.000
H7	1.759	1.311	0.883
H8	1.759	1.311	-0.883
H9	-0.003	-2.737	0.000
H10	-1.156	-1.693	0.887
H11	-1.156	-1.693	-0.887

	C1	C2	O3	O4	C5	H6	H7	H8	H9	H10	H11
C1		1.4927	2.4220	2.3308	3.6439	1.0891	1.0923	1.0923	4.3517	3.9991	3.9991
C2	1.4927		1.2192	1.3592	2.3338	2.1165	2.1316	2.1316	3.2300	2.6269	2.6269
O3	2.4220	1.2192		2.2799	2.6373	2.5707	3.1225	3.1225	3.7030	2.6195	2.6195
O4	2.3308	1.3592	2.2799		1.4264	3.2626	2.5987	2.5987	2.0216	2.0801	2.0801
C5	3.6439	2.3338	2.6373	1.4264		4.4412	3.9444	3.9444	1.0889	1.0918	1.0918
H6	1.0891	2.1165	2.5707	3.2626	4.4412		1.7846	1.7846	5.2665	4.6645	4.6645
H7	1.0923	2.1316	3.1225	2.5987	3.9444	1.7846		1.7656	4.5027	4.1860	4.5446
H8	1.0923	2.1316	3.1225	2.5987	3.9444	1.7846	1.7656		4.5027	4.5446	4.1860
H9	4.3517	3.2300	3.7030	2.0216	1.0889	5.2665	4.5027	4.5027		1.7901	1.7901
H10	3.9991	2.6269	2.6195	2.0801	1.0918	4.6645	4.1860	4.5446	1.7901		1.7732
H11	3.9991	2.6269	2.6195	2.0801	1.0918	4.6645	4.5446	4.1860	1.7901	1.7732

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.237	C1	C2	O4	109.539
C2	C1	H6	109.129	C2	C1	H7	110.136
C2	C1	H8	110.136	C2	O4	C5	113.799
O3	C2	O4	124.223	O4	C5	H9	106.199
O4	C5	H10	110.686	O4	C5	H11	110.686
H6	C1	H7	109.791	H6	C1	H8	109.791
H7	C1	H8	107.845	H9	C5	H10	110.341
H9	C5	H11	110.341	H10	C5	H11	108.586

All results from a given calculation for CH₃COOCH₃ (methyl acetate)

using model chemistry: MP2=FULL/6-31G*

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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All results from a given calculation for CH3COOCH3 (methyl acetate)

using model chemistry: MP2=FULL/6-31G*

States and conformations

All results from a given calculation for CH₃COOCH₃ (methyl acetate)