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	hartrees
Energy at 0K	-538.587428
Energy at 298.15K	-538.592934
HF Energy	-538.158458
Nuclear repulsion energy	102.465396

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3189	3037	15.14
2	A'	3129	2980	19.26
3	A'	3090	2943	14.68
4	A'	1500	1429	2.12
5	A'	1493	1422	0.62
6	A'	1410	1343	5.15
7	A'	1328	1265	35.54
8	A'	1108	1055	0.61
9	A'	1009	961	16.67
10	A'	713	679	20.64
11	A'	339	322	2.26
12	A"	3213	3060	19.35
13	A"	3191	3039	0.31
14	A"	1485	1414	7.29
15	A"	1282	1221	0.50
16	A"	1087	1035	0.00
17	A"	792	754	2.55
18	A"	283	270	0.12

Atom	x (Å)	y (Å)	z (Å)
C1	1.511	0.650	0.000
C2	0.000	0.813	0.000
H3	1.991	1.643	0.000
H4	1.844	0.099	0.893
H5	1.844	0.099	-0.893
Cl6	-0.826	-0.783	0.000
H7	-0.350	1.351	0.894
H8	-0.350	1.351	-0.894

	C1	C2	H3	H4	H5	Cl6	H7	H8
C1		1.5200	1.1037	1.1012	1.1012	2.7418	2.1810	2.1810
C2	1.5200		2.1576	2.1700	2.1700	1.7976	1.1006	1.1006
H3	1.1037	2.1576		1.7906	1.7906	3.7187	2.5237	2.5237
H4	1.1012	2.1700	1.7906		1.7868	2.9506	2.5268	3.0950
H5	1.1012	2.1700	1.7906	1.7868		2.9506	3.0950	2.5268
Cl6	2.7418	1.7976	3.7187	2.9506	2.9506		2.3625	2.3625
H7	2.1810	1.1006	2.5237	2.5268	3.0950	2.3625		1.7875
H8	2.1810	1.1006	2.5237	3.0950	2.5268	2.3625	1.7875

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	111.193	C1	C2	H7	111.665
C1	C2	H8	111.665	C2	C1	H3	109.622
C2	C1	H4	110.749	C2	C1	H5	110.749
H3	C1	H4	108.608	H3	C1	H5	108.608
H4	C1	H5	108.445	Cl6	C2	H7	106.729
Cl6	C2	H8	106.729	H7	C2	H8	108.606

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

using model chemistry: MP2/cc-pVDZ

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-pVDZ

States and conformations

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