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	hartrees
Energy at 0K	-1036.781768
Energy at 298.15K
HF Energy	-1036.074848
Nuclear repulsion energy	296.077271

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3245	3052	7.48	67.80	0.74	0.85
2	A₁	3130	2944	11.53	246.65	0.00	0.01
3	A₁	1531	1440	3.81	13.51	0.74	0.85
4	A₁	1467	1380	6.19	0.97	0.41	0.58
5	A₁	1222	1149	29.33	3.36	0.34	0.51
6	A₁	968	911	7.70	7.78	0.70	0.83
7	A₁	589	554	13.24	16.54	0.02	0.04
8	A₁	378	356	0.33	2.20	0.33	0.50
9	A₁	268	252	0.97	2.94	0.71	0.83
10	A₂	3225	3034	0.00	10.03	0.75	0.86
11	A₂	1517	1427	0.00	14.84	0.75	0.86
12	A₂	1056	993	0.00	0.99	0.75	0.86
13	A₂	294	277	0.00	1.10	0.75	0.86
14	A₂	283	266	0.00	0.18	0.75	0.86
15	B₁	3230	3038	17.08	112.14	0.75	0.86
16	B₁	1537	1446	8.27	0.00	0.75	0.86
17	B₁	1181	1110	76.15	2.81	0.75	0.86
18	B₁	720	677	80.03	12.48	0.75	0.86
19	B₁	375	353	1.63	1.49	0.75	0.86
20	B₁	321	302	0.01	0.00	0.75	0.86
21	B₂	3244	3051	4.14	32.27	0.75	0.86
22	B₂	3127	2941	6.24	0.75	0.75	0.86
23	B₂	1517	1427	4.21	0.00	0.75	0.86
24	B₂	1448	1362	15.25	1.54	0.75	0.86
25	B₂	1255	1180	4.55	2.55	0.75	0.86
26	B₂	983	924	0.01	1.75	0.75	0.86
27	B₂	403	379	2.63	1.25	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.332
Cl2	1.457	0.000	-0.715
Cl3	-1.457	0.000	-0.715
C4	0.000	1.264	1.171
C5	0.000	-1.264	1.171
H6	0.000	2.149	0.537
H7	0.000	-2.149	0.537
H8	-0.888	1.279	1.801
H9	0.888	1.279	1.801
H10	0.888	-1.279	1.801
H11	-0.888	-1.279	1.801

	C1	Cl2	Cl3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.7950	1.7950	1.5170	1.5170	2.1583	2.1583	2.1405	2.1405	2.1405	2.1405
Cl2	1.7950		2.9149	2.6981	2.6981	2.8826	2.8826	3.6704	2.8798	2.8798	3.6704
Cl3	1.7950	2.9149		2.6981	2.6981	2.8826	2.8826	2.8798	3.6704	3.6704	2.8798
C4	1.5170	2.6981	2.6981		2.5288	1.0875	3.4712	1.0895	1.0895	2.7667	2.7667
C5	1.5170	2.6981	2.6981	2.5288		3.4712	1.0875	2.7667	2.7667	1.0895	1.0895
H6	2.1583	2.8826	2.8826	1.0875	3.4712		4.2971	1.7730	1.7730	3.7594	3.7594
H7	2.1583	2.8826	2.8826	3.4712	1.0875	4.2971		3.7594	3.7594	1.7730	1.7730
H8	2.1405	3.6704	2.8798	1.0895	2.7667	1.7730	3.7594		1.7765	3.1139	2.5575
H9	2.1405	2.8798	3.6704	1.0895	2.7667	1.7730	3.7594	1.7765		2.5575	3.1139
H10	2.1405	2.8798	3.6704	2.7667	1.0895	3.7594	1.7730	3.1139	2.5575		1.7765
H11	2.1405	3.6704	2.8798	2.7667	1.0895	3.7594	1.7730	2.5575	3.1139	1.7765

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H6	110.846	C1	C4	H8	109.319
C1	C4	H9	109.319	C1	C5	H7	110.846
C1	C5	H10	109.319	C1	C5	H11	109.319
Cl2	C1	Cl3	108.570	Cl2	C1	C4	108.816
Cl2	C1	C5	108.816	Cl3	C1	C4	108.816
Cl3	C1	C5	108.816	C4	C1	C5	112.921
H6	C4	H8	109.054	H6	C4	H9	109.054
H7	C5	H10	109.054	H7	C5	H11	109.054
H8	C4	H9	109.225	H10	C5	H11	109.225

All results from a given calculation for CH₃CCl₂CH₃ (Propane, 2,2-dichloro-)

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

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 CH3CCl2CH3 (Propane, 2,2-dichloro-)

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

States and conformations

All results from a given calculation for CH₃CCl₂CH₃ (Propane, 2,2-dichloro-)