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	hartrees
Energy at 0K	-267.715208
Energy at 298.15K	-267.722369
HF Energy	-266.841899
Nuclear repulsion energy	176.898792

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3180	3180
2	A'	3135	3135
3	A'	3116	3116
4	A'	3094	3094
5	A'	1779	1779
6	A'	1555	1555
7	A'	1536	1536
8	A'	1466	1466
9	A'	1421	1421
10	A'	1416	1416
11	A'	1224	1224
12	A'	1155	1155
13	A'	1053	1053
14	A'	866	866
15	A'	782	782
16	A'	383	383
17	A'	228	228
18	A"	3195	3195
19	A"	3167	3167
20	A"	1524	1524
21	A"	1311	1311
22	A"	1202	1202
23	A"	1034	1034
24	A"	824	824
25	A"	339	339
26	A"	239	239
27	A"	53	53

Atom	x (Å)	y (Å)	z (Å)
C1	-2.183	-0.254	0.000
C2	-0.702	-0.566	0.000
O3	0.000	0.710	0.000
C4	1.346	0.620	0.000
O5	1.990	-0.413	0.000
H6	-2.752	-1.185	0.000
H7	-2.455	0.320	0.886
H8	-2.455	0.320	-0.886
H9	-0.397	-1.127	-0.884
H10	-0.397	-1.127	0.884
H11	1.778	1.625	0.000

	C1	C2	O3	C4	O5	H6	H7	H8	H9	H10	H11
C1		1.5138	2.3866	3.6354	4.1763	1.0916	1.0902	1.0902	2.1763	2.1763	4.3839
C2	1.5138		1.4564	2.3661	2.6963	2.1418	2.1550	2.1550	1.0908	1.0908	3.3089
O3	2.3866	1.4564		1.3486	2.2849	3.3419	2.6395	2.6395	2.0770	2.0770	1.9992
C4	3.6354	2.3661	1.3486		1.2171	4.4778	3.9144	3.9144	2.6206	2.6206	1.0943
O5	4.1763	2.6963	2.2849	1.2171		4.8047	4.5916	4.5916	2.6434	2.6434	2.0490
H6	1.0916	2.1418	3.3419	4.4778	4.8047		1.7718	1.7718	2.5168	2.5168	5.3308
H7	1.0902	2.1550	2.6395	3.9144	4.5916	1.7718		1.7728	3.0767	2.5161	4.5174
H8	1.0902	2.1550	2.6395	3.9144	4.5916	1.7718	1.7728		2.5161	3.0767	4.5174
H9	2.1763	1.0908	2.0770	2.6206	2.6434	2.5168	3.0767	2.5161		1.7685	3.6169
H10	2.1763	1.0908	2.0770	2.6206	2.6434	2.5168	2.5161	3.0767	1.7685		3.6169
H11	4.3839	3.3089	1.9992	1.0943	2.0490	5.3308	4.5174	4.5174	3.6169	3.6169

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	106.923	C1	C2	H9	112.333
C1	C2	H10	112.333	C2	C1	H6	109.511
C2	C1	H7	110.646	C2	C1	H8	110.646
C2	O3	C4	114.976	O3	C2	H9	108.400
O3	C2	H10	108.400	O3	C4	O5	125.810
O3	C4	H11	109.406	O5	C4	H11	124.783
H6	C1	H7	108.597	H6	C1	H8	108.597
H7	C1	H8	108.790	H9	C2	H10	108.311

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

using model chemistry: QCISD(T)=FULL/6-31+G**

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: QCISD(T)=FULL/6-31+G**

States and conformations

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