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	hartrees
Energy at 0K	-267.745521
Energy at 298.15K	-267.752742
HF Energy	-266.887488
Nuclear repulsion energy	177.385439

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3113	2997
2	A'	3057	2942
3	A'	3054	2939
4	A'	3035	2922
5	A'	1806	1739
6	A'	1543	1485
7	A'	1519	1462
8	A'	1452	1398
9	A'	1413	1360
10	A'	1408	1355
11	A'	1227	1181
12	A'	1150	1107
13	A'	1055	1015
14	A'	876	844
15	A'	794	764
16	A'	387	372
17	A'	236	227
18	A"	3126	3009
19	A"	3098	2982
20	A"	1509	1452
21	A"	1316	1267
22	A"	1200	1155
23	A"	1033	994
24	A"	816	786
25	A"	343	330
26	A"	242	233
27	A"	72	69

Atom	x (Å)	y (Å)	z (Å)
C1	-2.178	-0.261	0.000
C2	-0.691	-0.562	0.000
O3	0.000	0.711	0.000
C4	1.340	0.617	0.000
O5	1.979	-0.406	0.000
H6	-2.749	-1.199	0.000
H7	-2.456	0.315	0.890
H8	-2.456	0.315	-0.890
H9	-0.384	-1.130	-0.887
H10	-0.384	-1.130	0.887
H11	1.774	1.630	0.000

	C1	C2	O3	C4	O5	H6	H7	H8	H9	H10	H11
C1		1.5176	2.3856	3.6270	4.1596	1.0976	1.0962	1.0962	2.1824	2.1824	4.3823
C2	1.5176		1.4487	2.3491	2.6742	2.1542	2.1627	2.1627	1.0969	1.0969	3.2996
O3	2.3856	1.4487		1.3438	2.2720	3.3474	2.6422	2.6422	2.0793	2.0793	1.9986
C4	3.6270	2.3491	1.3438		1.2057	4.4747	3.9112	3.9112	2.6101	2.6101	1.1024
O5	4.1596	2.6742	2.2720	1.2057		4.7937	4.5801	4.5801	2.6250	2.6250	2.0466
H6	1.0976	2.1542	3.3474	4.4747	4.7937		1.7805	1.7805	2.5271	2.5271	5.3355
H7	1.0962	2.1627	2.6422	3.9112	4.5801	1.7805		1.7805	3.0888	2.5266	4.5189
H8	1.0962	2.1627	2.6422	3.9112	4.5801	1.7805	1.7805		2.5266	3.0888	4.5189
H9	2.1824	1.0969	2.0793	2.6101	2.6250	2.5271	3.0888	2.5266		1.7732	3.6147
H10	2.1824	1.0969	2.0793	2.6101	2.6250	2.5271	2.5266	3.0888	1.7732		3.6147
H11	4.3823	3.2996	1.9986	1.1024	2.0466	5.3355	4.5189	4.5189	3.6147	3.6147

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	107.053	C1	C2	H9	112.174
C1	C2	H10	112.174	C2	C1	H6	109.886
C2	C1	H7	110.636	C2	C1	H8	110.636
C2	O3	C4	114.492	O3	C2	H9	108.749
O3	C2	H10	108.749	O3	C4	O5	125.952
O3	C4	H11	109.180	O5	C4	H11	124.868
H6	C1	H7	108.507	H6	C1	H8	108.507
H7	C1	H8	108.607	H9	C2	H10	107.851

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

using model chemistry: CCSD(T)/6-311G*

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: CCSD(T)/6-311G*

States and conformations

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