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	hartrees
Energy at 0K	-1036.724194
Energy at 298.15K
HF Energy	-1036.063222
Nuclear repulsion energy	295.991973

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	3231	3047	5.59	67.56	0.74	0.85
2	A₁	3121	2943	7.80	186.45	0.01	0.01
3	A₁	1549	1461	3.06	25.58	0.75	0.86
4	A₁	1480	1396	7.63	2.68	0.38	0.55
5	A₁	1234	1164	32.00	0.92	0.19	0.32
6	A₁	972	917	7.28	7.87	0.75	0.86
7	A₁	591	558	14.02	12.15	0.04	0.08
8	A₁	380	358	0.54	1.98	0.36	0.53
9	A₁	270	255	1.22	3.64	0.66	0.80
10	A₂	3211	3028	0.00	8.46	0.75	0.86
11	A₂	1539	1451	0.00	26.35	0.75	0.86
12	A₂	1064	1003	0.00	3.86	0.75	0.86
13	A₂	300	282	0.00	0.69	0.75	0.86
14	A₂	289	272	0.00	0.44	0.75	0.86
15	B₁	3216	3033	13.84	112.77	0.75	0.86
16	B₁	1560	1471	8.87	0.01	0.75	0.86
17	B₁	1194	1126	82.51	0.66	0.75	0.86
18	B₁	724	683	79.62	12.93	0.75	0.86
19	B₁	376	354	1.88	1.17	0.75	0.86
20	B₁	327	309	0.02	0.00	0.75	0.86
21	B₂	3230	3046	3.29	34.09	0.75	0.86
22	B₂	3117	2940	3.26	0.02	0.75	0.86
23	B₂	1535	1448	4.93	0.03	0.75	0.86
24	B₂	1462	1379	16.88	5.00	0.75	0.86
25	B₂	1265	1193	5.87	0.23	0.75	0.86
26	B₂	990	933	0.18	2.40	0.75	0.86
27	B₂	403	380	3.24	1.30	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.332
Cl2	1.459	0.000	-0.714
Cl3	-1.459	0.000	-0.714
C4	0.000	1.266	1.168
C5	0.000	-1.266	1.168
H6	0.000	2.150	0.529
H7	0.000	-2.150	0.529
H8	-0.891	1.283	1.801
H9	0.891	1.283	1.801
H10	0.891	-1.283	1.801
H11	-0.891	-1.283	1.801

	C1	Cl2	Cl3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.7950	1.7950	1.5169	1.5169	2.1589	2.1589	2.1438	2.1438	2.1438	2.1438
Cl2	1.7950		2.9171	2.6967	2.6967	2.8800	2.8800	3.6729	2.8794	2.8794	3.6729
Cl3	1.7950	2.9171		2.6967	2.6967	2.8800	2.8800	2.8794	3.6729	3.6729	2.8794
C4	1.5169	2.6967	2.6967		2.5317	1.0910	3.4751	1.0929	1.0929	2.7729	2.7729
C5	1.5169	2.6967	2.6967	2.5317		3.4751	1.0910	2.7729	2.7729	1.0929	1.0929
H6	2.1589	2.8800	2.8800	1.0910	3.4751		4.2999	1.7786	1.7786	3.7675	3.7675
H7	2.1589	2.8800	2.8800	3.4751	1.0910	4.2999		3.7675	3.7675	1.7786	1.7786
H8	2.1438	3.6729	2.8794	1.0929	2.7729	1.7786	3.7675		1.7822	3.1237	2.5654
H9	2.1438	2.8794	3.6729	1.0929	2.7729	1.7786	3.7675	1.7822		2.5654	3.1237
H10	2.1438	2.8794	3.6729	2.7729	1.0929	3.7675	1.7786	3.1237	2.5654		1.7822
H11	2.1438	3.6729	2.8794	2.7729	1.0929	3.7675	1.7786	2.5654	3.1237	1.7822

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H6	110.696	C1	C4	H8	109.379
C1	C4	H9	109.379	C1	C5	H7	110.696
C1	C5	H10	109.379	C1	C5	H11	109.379
Cl2	C1	Cl3	108.694	Cl2	C1	C4	108.735
Cl2	C1	C5	108.735	Cl3	C1	C4	108.735
Cl3	C1	C5	108.735	C4	C1	C5	113.124
H6	C4	H8	109.064	H6	C4	H9	109.064
H7	C5	H10	109.064	H7	C5	H11	109.064
H8	C4	H9	109.238	H10	C5	H11	109.238

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

using model chemistry: MP2/6-31G*

States and conformations

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