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	hartrees
Energy at 0K	-43.190900
Energy at 298.15K	-43.195663
HF Energy	-42.676749
Nuclear repulsion energy	64.765301

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3222	3059	18.40
2	A'	3197	3035	4.35
3	A'	3102	2945	12.50
4	A'	1508	1432	6.93
5	A'	1446	1373	7.84
6	A'	1332	1264	19.54
7	A'	1134	1077	3.68
8	A'	1014	963	12.84
9	A'	674	640	12.00
10	A'	410	389	4.37
11	A'	281	267	1.24
12	A"	3207	3045	13.93
13	A"	1509	1433	1.82
14	A"	1301	1235	51.58
15	A"	1100	1044	44.72
16	A"	756	717	102.48
17	A"	325	309	0.48
18	A"	282	267	0.10

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.545	0.000
C2	-1.483	0.940	0.000
H3	0.665	1.420	0.000
Cl4	0.404	-0.395	1.480
Cl5	0.404	-0.395	-1.480
H6	-2.117	0.038	0.000
H7	-1.700	1.539	0.901
H8	-1.700	1.539	-0.901

	C1	C2	H3	Cl4	Cl5	H6	H7	H8
C1		1.5348	1.0994	1.7994	1.7994	2.1763	2.1654	2.1654
C2	1.5348		2.2012	2.7451	2.7451	1.1018	1.1035	1.1035
H3	1.0994	2.2012		2.3567	2.3567	3.1060	2.5333	2.5333
Cl4	1.7994	2.7451	2.3567		2.9602	2.9554	2.9160	3.7199
Cl5	1.7994	2.7451	2.3567	2.9602		2.9554	3.7199	2.9160
H6	2.1763	1.1018	3.1060	2.9554	2.9554		1.7992	1.7992
H7	2.1654	1.1035	2.5333	2.9160	3.7199	1.7992		1.8020
H8	2.1654	1.1035	2.5333	3.7199	2.9160	1.7992	1.8020

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	110.184	C1	C2	H7	109.233
C1	C2	H8	109.233	C2	C1	H3	112.310
C2	C1	Cl4	110.588	C2	C1	Cl5	110.588
H3	C1	Cl4	106.258	H3	C1	Cl5	106.258
Cl4	C1	Cl5	110.684	H6	C2	H7	109.349
H6	C2	H8	109.349	H7	C2	H8	109.479

All results from a given calculation for CH₃CHCl₂ (Ethane, 1,1-dichloro-)

using model chemistry: MP2/CEP-31G*

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 CH3CHCl2 (Ethane, 1,1-dichloro-)

using model chemistry: MP2/CEP-31G*

States and conformations

All results from a given calculation for CH₃CHCl₂ (Ethane, 1,1-dichloro-)