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	hartrees
Energy at 0K	-538.557428
Energy at 298.15K	-538.562945
HF Energy	-538.131151
Nuclear repulsion energy	102.726755

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3191	2995	20.68
2	A'	3161	2967	13.48
3	A'	3111	2920	13.57
4	A'	1561	1465	3.07
5	A'	1553	1458	1.97
6	A'	1478	1387	7.75
7	A'	1390	1305	36.61
8	A'	1132	1063	1.03
9	A'	1031	968	15.94
10	A'	718	674	22.35
11	A'	344	323	2.38
12	A"	3226	3028	19.80
13	A"	3202	3005	2.91
14	A"	1546	1451	7.54
15	A"	1325	1244	0.55
16	A"	1134	1065	0.01
17	A"	814	764	3.12
18	A"	276	259	0.13

Atom	x (Å)	y (Å)	z (Å)
C1	1.510	0.652	0.000
C2	0.000	0.811	0.000
H3	1.981	1.640	0.000
H4	1.843	0.107	0.887
H5	1.843	0.107	-0.887
Cl6	-0.825	-0.784	0.000
H7	-0.347	1.343	0.886
H8	-0.347	1.343	-0.886

	C1	C2	H3	H4	H5	Cl6	H7	H8
C1		1.5181	1.0951	1.0925	1.0925	2.7409	2.1705	2.1705
C2	1.5181		2.1471	2.1632	2.1632	1.7957	1.0904	1.0904
H3	1.0951	2.1471		1.7762	1.7762	3.7079	2.5082	2.5082
H4	1.0925	2.1632	1.7762		1.7731	2.9499	2.5150	3.0770
H5	1.0925	2.1632	1.7762	1.7731		2.9499	3.0770	2.5150
Cl6	2.7409	1.7957	3.7079	2.9499	2.9499		2.3532	2.3532
H7	2.1705	1.0904	2.5082	2.5150	3.0770	2.3532		1.7726
H8	2.1705	1.0904	2.5082	3.0770	2.5150	2.3532	1.7726

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	111.333	C1	C2	H7	111.575
C1	C2	H8	111.575	C2	C1	H3	109.435
C2	C1	H4	110.863	C2	C1	H5	110.863
H3	C1	H4	108.568	H3	C1	H5	108.568
H4	C1	H5	108.481	Cl6	C2	H7	106.683
Cl6	C2	H8	106.683	H7	C2	H8	108.741

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

using model chemistry: MP3/6-31G*

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 CH3CH2Cl (Ethyl chloride)

using model chemistry: MP3/6-31G*

States and conformations

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