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	hartrees
Energy at 0K	-267.629466
Energy at 298.15K	-267.636716
HF Energy	-266.846101
Nuclear repulsion energy	177.150777

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3200	3048	15.01
2	A'	3106	2959	2.60
3	A'	3104	2956	83.23
4	A'	3097	2950	14.98
5	A'	1812	1726	253.99
6	A'	1520	1448	6.73
7	A'	1499	1428	2.12
8	A'	1432	1364	19.96
9	A'	1405	1338	0.48
10	A'	1387	1321	2.11
11	A'	1231	1173	415.75
12	A'	1146	1092	8.25
13	A'	1066	1015	16.03
14	A'	877	835	10.21
15	A'	793	756	3.67
16	A'	385	366	5.93
17	A'	234	223	5.75
18	A"	3207	3055	22.57
19	A"	3165	3014	14.72
20	A"	1484	1413	5.95
21	A"	1303	1241	1.33
22	A"	1187	1131	4.61
23	A"	1047	998	0.05
24	A"	815	776	0.49
25	A"	353	336	18.36
26	A"	250	238	2.43
27	A"	73	69	0.39

Atom	x (Å)	y (Å)	z (Å)
C1	-2.177	-0.249	0.000
C2	-0.692	-0.555	0.000
O3	0.000	0.715	0.000
C4	1.344	0.609	0.000
O5	1.975	-0.424	0.000
H6	-2.753	-1.188	0.000
H7	-2.452	0.332	0.894
H8	-2.452	0.332	-0.894
H9	-0.388	-1.131	-0.890
H10	-0.388	-1.131	0.890
H11	1.779	1.629	0.000

	C1	C2	O3	C4	O5	H6	H7	H8	H9	H10	H11
C1		1.5155	2.3806	3.6237	4.1557	1.1019	1.1011	1.1011	2.1840	2.1840	4.3791
C2	1.5155		1.4468	2.3458	2.6709	2.1560	2.1641	2.1641	1.1027	1.1027	3.2985
O3	2.3806	1.4468		1.3481	2.2805	3.3471	2.6379	2.6379	2.0860	2.0860	2.0003
C4	3.6237	2.3458	1.3481		1.2114	4.4743	3.9097	3.9097	2.6116	2.6116	1.1085
O5	4.1557	2.6709	2.2805	1.2114		4.7901	4.5798	4.5798	2.6222	2.6222	2.0625
H6	1.1019	2.1560	3.3471	4.4743	4.7901		1.7889	1.7889	2.5280	2.5280	5.3368
H7	1.1011	2.1641	2.6379	3.9097	4.5798	1.7889		1.7873	3.0958	2.5306	4.5151
H8	1.1011	2.1641	2.6379	3.9097	4.5798	1.7889	1.7873		2.5306	3.0958	4.5151
H9	2.1840	1.1027	2.0860	2.6116	2.6222	2.5280	3.0958	2.5306		1.7791	3.6204
H10	2.1840	1.1027	2.0860	2.6116	2.6222	2.5280	2.5306	3.0958	1.7791		3.6204
H11	4.3791	3.2985	2.0003	1.1085	2.0625	5.3368	4.5151	4.5151	3.6204	3.6204

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.932	C1	C2	H9	112.090
C1	C2	H10	112.090	C2	C1	H6	109.912
C2	C1	H7	110.596	C2	C1	H8	110.596
C2	O3	C4	114.092	O3	C2	H9	109.064
O3	C2	H10	109.064	O3	C4	O5	125.915
O3	C4	H11	108.637	O5	C4	H11	125.448
H6	C1	H7	108.587	H6	C1	H8	108.587
H7	C1	H8	108.506	H9	C2	H10	107.545

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

using model chemistry: MP2/cc-pVDZ

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/cc-pVDZ

States and conformations

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