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	hartrees
Energy at 0K	-267.910053
Energy at 298.15K	-267.917267
HF Energy	-266.939702
Nuclear repulsion energy	178.083037

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3183	3029	13.10
2	A'	3110	2959	30.50
3	A'	3108	2957	31.44
4	A'	3092	2942	11.12
5	A'	1779	1693	285.63
6	A'	1533	1458	8.14
7	A'	1514	1441	2.37
8	A'	1435	1366	15.80
9	A'	1410	1342	1.84
10	A'	1400	1332	2.03
11	A'	1227	1168	417.90
12	A'	1145	1090	6.66
13	A'	1056	1005	17.16
14	A'	871	829	10.89
15	A'	790	752	2.87
16	A'	383	364	5.06
17	A'	230	219	6.83
18	A"	3192	3037	21.37
19	A"	3160	3006	5.26
20	A"	1502	1429	6.41
21	A"	1312	1248	1.53
22	A"	1191	1133	3.80
23	A"	1049	998	0.08
24	A"	816	776	0.58
25	A"	350	333	19.79
26	A"	243	231	2.24
27	A"	68	65	0.59

Atom	x (Å)	y (Å)	z (Å)
C1	-2.169	-0.258	0.000
C2	-0.692	-0.558	0.000
O3	0.000	0.709	0.000
C4	1.337	0.615	0.000
O5	1.971	-0.411	0.000
H6	-2.732	-1.189	0.000
H7	-2.445	0.313	0.883
H8	-2.445	0.313	-0.883
H9	-0.386	-1.121	-0.880
H10	-0.386	-1.121	0.880
H11	1.768	1.619	0.000

	C1	C2	O3	C4	O5	H6	H7	H8	H9	H10	H11
C1		1.5075	2.3749	3.6128	4.1432	1.0882	1.0872	1.0872	2.1672	2.1672	4.3619
C2	1.5075		1.4439	2.3431	2.6672	2.1360	2.1475	2.1475	1.0882	1.0882	3.2852
O3	2.3749	1.4439		1.3402	2.2674	3.3271	2.6294	2.6294	2.0672	2.0672	1.9886
C4	3.6128	2.3431	1.3402		1.2057	4.4510	3.8950	3.8950	2.5991	2.5991	1.0934
O5	4.1432	2.6672	2.2674	1.2057		4.7677	4.5614	4.5614	2.6148	2.6148	2.0401
H6	1.0882	2.1360	3.3271	4.4510	4.7677		1.7660	1.7660	2.5065	2.5065	5.3049
H7	1.0872	2.1475	2.6294	3.8950	4.5614	1.7660		1.7664	3.0662	2.5087	4.4984
H8	1.0872	2.1475	2.6294	3.8950	4.5614	1.7660	1.7664		2.5087	3.0662	4.4984
H9	2.1672	1.0882	2.0672	2.5991	2.6148	2.5065	3.0662	2.5087		1.7594	3.5951
H10	2.1672	1.0882	2.0672	2.5991	2.6148	2.5065	2.5087	3.0662	1.7594		3.5951
H11	4.3619	3.2852	1.9886	1.0934	2.0401	5.3049	4.4984	4.4984	3.5951	3.5951

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	107.140	C1	C2	H9	112.214
C1	C2	H10	112.214	C2	C1	H6	109.694
C2	C1	H7	110.678	C2	C1	H8	110.678
C2	O3	C4	114.568	O3	C2	H9	108.641
O3	C2	H10	108.641	O3	C4	O5	125.812
O3	C4	H11	109.183	O5	C4	H11	125.005
H6	C1	H7	108.544	H6	C1	H8	108.544
H7	C1	H8	108.646	H9	C2	H10	107.890

All results from a given calculation for HCOOC₂H₅ (Ethyl formate)

using model chemistry: MP2/Def2TZVPP

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 HCOOC2H5 (Ethyl formate)

using model chemistry: MP2/Def2TZVPP

States and conformations

All results from a given calculation for HCOOC₂H₅ (Ethyl formate)