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	hartrees
Energy at 0K	-997.581946
Energy at 298.15K	-997.586785
HF Energy	-997.031576
Nuclear repulsion energy	209.379806

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3264	3056	7.05
2	A'	3229	3024	3.01
3	A'	3148	2948	5.67
4	A'	1541	1443	6.37
5	A'	1468	1375	7.64
6	A'	1363	1277	13.54
7	A'	1149	1076	3.68
8	A'	1032	967	10.77
9	A'	685	641	11.05
10	A'	419	392	4.03
11	A'	291	272	1.26
12	A"	3251	3044	6.66
13	A"	1545	1447	1.61
14	A"	1333	1248	45.45
15	A"	1118	1047	37.03
16	A"	764	715	92.59
17	A"	333	312	0.38
18	A"	289	270	0.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.536	0.000
C2	-1.458	0.933	0.000
H3	0.653	1.403	0.000
Cl4	0.398	-0.392	1.466
Cl5	0.398	-0.392	-1.466
H6	-2.087	0.047	0.000
H7	-1.674	1.524	0.887
H8	-1.674	1.524	-0.887

	C1	C2	H3	Cl4	Cl5	H6	H7	H8
C1		1.5107	1.0851	1.7799	1.7799	2.1440	2.1367	2.1367
C2	1.5107		2.1625	2.7104	2.7104	1.0866	1.0877	1.0877
H3	1.0851	2.1625		2.3311	2.3311	3.0575	2.4934	2.4934
Cl4	1.7799	2.7104	2.3311		2.9318	2.9187	2.8808	3.6741
Cl5	1.7799	2.7104	2.3311	2.9318		2.9187	3.6741	2.8808
H6	2.1440	1.0866	3.0575	2.9187	2.9187		1.7717	1.7717
H7	2.1367	1.0877	2.4934	2.8808	3.6741	1.7717		1.7736
H8	2.1367	1.0877	2.4934	3.6741	2.8808	1.7717	1.7736

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	110.203	C1	C2	H7	109.555
C1	C2	H8	109.555	C2	C1	H3	111.787
C2	C1	Cl4	110.643	C2	C1	Cl5	110.643
H3	C1	Cl4	106.366	H3	C1	Cl5	106.366
Cl4	C1	Cl5	110.887	H6	C2	H7	109.137
H6	C2	H8	109.137	H7	C2	H8	109.235

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

using model chemistry: MP2/6-31G**

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: MP2/6-31G**

States and conformations

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