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	hartrees
Energy at 0K	-93.534787
Energy at 298.15K	-93.540217
HF Energy	-93.324697
Nuclear repulsion energy	62.332289

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3133	3017	42.37
2	A'	3110	2995	19.43
3	A'	3031	2920	23.85
4	A'	1539	1482	6.03
5	A'	1522	1466	1.12
6	A'	1467	1413	8.07
7	A'	1365	1314	36.69
8	A'	1105	1064	2.07
9	A'	1001	964	17.83
10	A'	624	601	19.39
11	A'	324	312	3.45
12	A"	3199	3081	32.51
13	A"	3151	3034	15.75
14	A"	1523	1467	8.93
15	A"	1299	1251	1.33
16	A"	1097	1057	0.21
17	A"	815	785	5.05
18	A"	273	263	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	1.186	-0.366	0.000
C2	0.000	0.624	0.000
H3	2.136	0.202	0.000
H4	1.162	-1.009	0.895
H5	1.162	-1.009	-0.895
Cl6	-1.647	-0.319	0.000
H7	-0.025	1.251	0.902
H8	-0.025	1.251	-0.902

	C1	C2	H3	H4	H5	Cl6	H7	H8
C1		1.5447	1.1061	1.1025	1.1025	2.8333	2.2116	2.2116
C2	1.5447		2.1770	2.1952	2.1952	1.8977	1.0985	1.0985
H3	1.1061	2.1770		1.7928	1.7928	3.8182	2.5652	2.5652
H4	1.1025	2.1952	1.7928		1.7895	3.0279	2.5526	3.1215
H5	1.1025	2.1952	1.7928	1.7895		3.0279	3.1215	2.5526
Cl6	2.8333	1.8977	3.8182	3.0279	3.0279		2.4309	2.4309
H7	2.2116	1.0985	2.5652	2.5526	3.1215	2.4309		1.8038
H8	2.2116	1.0985	2.5652	3.1215	2.5526	2.4309	1.8038

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	110.362	C1	C2	H7	112.497
C1	C2	H8	112.497	C2	C1	H3	109.307
C2	C1	H4	110.945	C2	C1	H5	110.945
H3	C1	H4	108.536	H3	C1	H5	108.536
H4	C1	H5	108.506	Cl6	C2	H7	105.312
Cl6	C2	H8	105.312	H7	C2	H8	110.377

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

using model chemistry: MP2/LANL2DZ

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/LANL2DZ

States and conformations

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