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	hartrees
Energy at 0K	-228.552446
Energy at 298.15K	-228.557405
HF Energy	-227.868681
Nuclear repulsion energy	122.288316

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3243	3074	10.44
2	A'	3130	2967	42.64
3	A'	3112	2950	28.24
4	A'	1786	1693	279.53
5	A'	1528	1448	10.17
6	A'	1507	1429	2.58
7	A'	1440	1365	1.22
8	A'	1260	1194	207.59
9	A'	1211	1148	136.19
10	A'	961	911	28.12
11	A'	785	744	7.98
12	A'	313	297	13.66
13	A"	3205	3038	17.17
14	A"	1510	1431	7.72
15	A"	1204	1141	2.08
16	A"	1043	989	0.00
17	A"	343	326	28.00
18	A"	159	150	0.15

Atom	x (Å)	y (Å)	z (Å)
C1	1.356	0.401	0.000
O2	0.000	0.881	0.000
C3	-0.930	-0.087	0.000
O4	-0.713	-1.274	0.000
H5	1.976	1.290	0.000
H6	1.545	-0.200	0.887
H7	1.545	-0.200	-0.887
H8	-1.923	0.371	0.000

	C1	O2	C3	O4	H5	H6	H7	H8
C1		1.4383	2.3373	2.6619	1.0843	1.0879	1.0879	3.2795
O2	1.4383		1.3417	2.2696	2.0183	2.0839	2.0839	1.9897
C3	2.3373	1.3417		1.2073	3.2159	2.6318	2.6318	1.0937
O4	2.6619	2.2696	1.2073		3.7158	2.6531	2.6531	2.0426
H5	1.0843	2.0183	3.2159	3.7158		1.7870	1.7870	4.0065
H6	1.0879	2.0839	2.6318	2.6531	1.7870		1.7736	3.6256
H7	1.0879	2.0839	2.6318	2.6531	1.7870	1.7736		3.6256
H8	3.2795	1.9897	1.0937	2.0426	4.0065	3.6256	3.6256

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	C3	114.396	O2	C1	H5	105.417
O2	C1	H6	110.388	O2	C1	H7	110.388
O2	C3	O4	125.759	O2	C3	H8	109.145
O4	C3	H8	125.096	H5	C1	H6	110.705
H5	C1	H7	110.705	H6	C1	H7	109.201

All results from a given calculation for CH₃OCHO (methyl formate)

using model chemistry: MP2/TZVP

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 CH3OCHO (methyl formate)

using model chemistry: MP2/TZVP

States and conformations

All results from a given calculation for CH₃OCHO (methyl formate)