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	hartrees
Energy at 0K	-726.781186
Energy at 298.15K	-726.787584
HF Energy	-725.813527
Nuclear repulsion energy	292.782934

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3202	3042	23.22
2	A	3186	3028	13.23
3	A	3178	3019	2.02
4	A	3117	2962	11.82
5	A	3093	2939	10.16
6	A	1888	1794	466.08
7	A	1543	1466	6.37
8	A	1521	1445	4.23
9	A	1502	1427	7.13
10	A	1453	1381	24.58
11	A	1417	1346	5.55
12	A	1339	1272	0.76
13	A	1211	1151	518.69
14	A	1200	1140	3.81
15	A	1160	1103	24.13
16	A	1072	1018	88.44
17	A	945	898	101.17
18	A	845	803	0.14
19	A	675	642	16.44
20	A	659	627	89.36
21	A	537	510	2.18
22	A	462	439	11.88
23	A	339	322	4.79
24	A	272	258	0.57
25	A	204	194	0.09
26	A	107	102	0.97
27	A	106	100	0.48

Atom	x (Å)	y (Å)	z (Å)
O1	-0.553	0.694	-0.000
H2	-1.150	-1.087	0.889
H3	-1.150	-1.087	-0.889
C4	-1.375	-0.495	-0.000
H5	-3.010	0.589	0.888
H6	-3.481	-0.875	0.000
H7	-3.011	0.589	-0.888
C8	-2.809	-0.013	0.000
O9	1.484	1.595	0.000
Cl10	1.458	-1.014	0.000
C11	0.777	0.640	0.000

	O1	H2	H3	C4	H5	H6	H7	C8	O9	Cl10	C11
O1		2.0786	2.0786	1.4455	2.6155	3.3222	2.6154	2.3645	2.2270	2.6386	1.3306
H2	2.0786		1.7774	1.0916	2.5042	2.5031	3.0705	2.1670	3.8632	2.7569	2.7363
H3	2.0786	1.7774		1.0916	3.0705	2.5032	2.5043	2.1671	3.8634	2.7572	2.7365
C4	1.4455	1.0916	1.0916		2.1536	2.1398	2.1536	1.5128	3.5413	2.8808	2.4328
H5	2.6155	2.5042	3.0705	2.1536		1.7762	1.7762	1.0916	4.6903	4.8301	3.8903
H6	3.3222	2.5031	2.5032	2.1398	1.7762		1.7762	1.0933	5.5454	4.9412	4.5193
H7	2.6154	3.0705	2.5043	2.1536	1.7762	1.7762		1.0916	4.6905	4.8303	3.8905
C8	2.3645	2.1670	2.1671	1.5128	1.0916	1.0933	1.0916		4.5842	4.3835	3.6449
O9	2.2270	3.8632	3.8634	3.5413	4.6903	5.5454	4.6905	4.5842		2.6093	1.1884
Cl10	2.6386	2.7569	2.7572	2.8808	4.8301	4.9412	4.8303	4.3835	2.6093		1.7890
C11	1.3306	2.7363	2.7365	2.4328	3.8903	4.5193	3.8905	3.6449	1.1884	1.7890

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C4	H2	109.234	O1	C4	H3	109.230
O1	C4	C8	106.102	O1	C11	O9	124.180
O1	C11	Cl10	114.724	H2	C4	H3	109.002
H2	C4	C8	111.597	H3	C4	C8	111.600
C4	O1	C11	122.350	C4	C8	H5	110.520
C4	C8	H6	109.332	C4	C8	H7	110.522
H5	C8	H6	108.769	H5	C8	H7	108.888
H6	C8	H7	108.768	O9	C11	Cl10	121.096

All results from a given calculation for C₃H₅ClO₂ (Carbonochloridic acid, ethyl ester)

using model chemistry: MP2/6-311G**

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 C3H5ClO2 (Carbonochloridic acid, ethyl ester)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for C₃H₅ClO₂ (Carbonochloridic acid, ethyl ester)