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	hartrees
Energy at 0K	-538.745814
Energy at 298.15K
HF Energy	-538.199146
Nuclear repulsion energy	103.197731

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3171	3011	15.33
2	A'	3127	2969	14.47
3	A'	3082	2926	13.09
4	A'	1517	1440	2.44
5	A'	1507	1431	1.21
6	A'	1416	1345	5.75
7	A'	1329	1261	30.69
8	A'	1105	1049	0.42
9	A'	1004	953	17.49
10	A'	710	674	20.48
11	A'	335	318	2.14
12	A"	3200	3038	14.51
13	A"	3177	3017	0.80
14	A"	1502	1426	8.15
15	A"	1289	1224	0.33
16	A"	1089	1034	0.00
17	A"	794	754	2.40
18	A"	270	256	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	1.502	0.644	0.000
C2	0.000	0.812	0.000
H3	1.981	1.623	0.000
H4	1.828	0.099	0.882
H5	1.828	0.099	-0.882
Cl6	-0.821	-0.779	0.000
H7	-0.348	1.339	0.883
H8	-0.348	1.339	-0.883

	C1	C2	H3	H4	H5	Cl6	H7	H8
C1		1.5115	1.0899	1.0872	1.0872	2.7241	2.1644	2.1644
C2	1.5115		2.1404	2.1514	2.1514	1.7901	1.0857	1.0857
H3	1.0899	2.1404		1.7682	1.7682	3.6903	2.5067	2.5067
H4	1.0872	2.1514	1.7682		1.7643	2.9263	2.5042	3.0641
H5	1.0872	2.1514	1.7682	1.7643		2.9263	3.0641	2.5042
Cl6	2.7241	1.7901	3.6903	2.9263	2.9263		2.3426	2.3426
H7	2.1644	1.0857	2.5067	2.5042	3.0641	2.3426		1.7670
H8	2.1644	1.0857	2.5067	3.0641	2.5042	2.3426	1.7670

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	110.914	C1	C2	H7	111.850
C1	C2	H8	111.850	C2	C1	H3	109.673
C2	C1	H4	110.702	C2	C1	H5	110.702
H3	C1	H4	108.622	H3	C1	H5	108.622
H4	C1	H5	108.461	Cl6	C2	H7	106.508
Cl6	C2	H8	106.508	H7	C2	H8	108.928

All results from a given calculation for CH₃CH₂Cl (Ethyl chloride)

using model chemistry: MP2/cc-pVTZ

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 CH3CH2Cl (Ethyl chloride)

using model chemistry: MP2/cc-pVTZ

States and conformations

All results from a given calculation for CH₃CH₂Cl (Ethyl chloride)