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	hartrees
Energy at 0K	-267.635950
Energy at 298.15K	-267.643223
HF Energy	-266.835521
Nuclear repulsion energy	177.644489

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3245	3032	15.82
2	A'	3157	2950	48.17
3	A'	3154	2947	27.72
4	A'	3146	2939	11.82
5	A'	1816	1697	244.44
6	A'	1578	1474	6.11
7	A'	1561	1458	2.29
8	A'	1481	1384	17.95
9	A'	1437	1342	0.80
10	A'	1433	1339	7.47
11	A'	1251	1168	402.63
12	A'	1172	1095	7.02
13	A'	1074	1004	13.98
14	A'	886	828	11.50
15	A'	798	745	3.99
16	A'	389	363	5.95
17	A'	234	219	6.95
18	A"	3256	3042	23.06
19	A"	3214	3003	12.95
20	A"	1550	1448	4.84
21	A"	1333	1246	0.70
22	A"	1221	1141	4.95
23	A"	1054	985	0.21
24	A"	836	781	0.30
25	A"	358	334	20.92
26	A"	254	237	2.72
27	A"	70	65	0.40

Atom	x (Å)	y (Å)	z (Å)
C1	-2.172	-0.244	0.000
C2	-0.697	-0.556	0.000
O3	0.000	0.712	0.000
C4	1.341	0.609	0.000
O5	1.976	-0.426	0.000
H6	-2.745	-1.169	0.000
H7	-2.441	0.330	0.883
H8	-2.441	0.330	-0.883
H9	-0.395	-1.122	-0.880
H10	-0.395	-1.122	0.880
H11	1.775	1.613	0.000

	C1	C2	O3	C4	O5	H6	H7	H8	H9	H10	H11
C1		1.5077	2.3730	3.6155	4.1514	1.0878	1.0865	1.0865	2.1686	2.1686	4.3624
C2	1.5077		1.4474	2.3483	2.6757	2.1373	2.1459	2.1459	1.0886	1.0886	3.2894
O3	2.3730	1.4474		1.3454	2.2800	3.3273	2.6232	2.6232	2.0723	2.0723	1.9911
C4	3.6155	2.3483	1.3454		1.2143	4.4562	3.8937	3.8937	2.6053	2.6053	1.0936
O5	4.1514	2.6757	2.2800	1.2143		4.7782	4.5665	4.5665	2.6225	2.6225	2.0492
H6	1.0878	2.1373	3.3273	4.4562	4.7782		1.7657	1.7657	2.5093	2.5093	5.3076
H7	1.0865	2.1459	2.6232	3.8937	4.5665	1.7657		1.7650	3.0658	2.5088	4.4945
H8	1.0865	2.1459	2.6232	3.8937	4.5665	1.7657	1.7650		2.5088	3.0658	4.4945
H9	2.1686	1.0886	2.0723	2.6053	2.6225	2.5093	3.0658	2.5088		1.7591	3.6011
H10	2.1686	1.0886	2.0723	2.6053	2.6225	2.5093	2.5088	3.0658	1.7591		3.6011
H11	4.3624	3.2894	1.9911	1.0936	2.0492	5.3076	4.4945	4.4945	3.6011	3.6011

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.823	C1	C2	H9	112.280
C1	C2	H10	112.280	C2	C1	H6	109.805
C2	C1	H7	110.574	C2	C1	H8	110.574
C2	O3	C4	114.411	O3	C2	H9	108.784
O3	C2	H10	108.784	O3	C4	O5	125.853
O3	C4	H11	109.007	O5	C4	H11	125.140
H6	C1	H7	108.599	H6	C1	H8	108.599
H7	C1	H8	108.634	H9	C2	H10	107.798

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

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 HCOOC2H5 (Ethyl formate)

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

States and conformations

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