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	hartrees
Energy at 0K	-538.674468
Energy at 298.15K	-538.680004
HF Energy	-538.170761
Nuclear repulsion energy	103.059203

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3178	3010	18.67
2	A'	3135	2969	18.62
3	A'	3089	2926	14.54
4	A'	1540	1459	4.14
5	A'	1527	1447	1.79
6	A'	1455	1378	10.73
7	A'	1380	1307	36.68
8	A'	1124	1064	0.83
9	A'	1021	967	19.18
10	A'	720	682	21.68
11	A'	343	325	2.04
12	A"	3209	3040	20.74
13	A"	3187	3018	1.13
14	A"	1526	1446	10.27
15	A"	1316	1247	1.73
16	A"	1128	1068	0.24
17	A"	809	766	4.38
18	A"	288	272	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	1.505	0.643	0.000
C2	0.000	0.810	0.000
H3	1.985	1.626	0.000
H4	1.835	0.097	0.884
H5	1.835	0.097	-0.884
Cl6	-0.823	-0.778	0.000
H7	-0.343	1.343	0.886
H8	-0.343	1.343	-0.886

	C1	C2	H3	H4	H5	Cl6	H7	H8
C1		1.5139	1.0935	1.0906	1.0906	2.7276	2.1654	2.1654
C2	1.5139		2.1458	2.1583	2.1583	1.7892	1.0894	1.0894
H3	1.0935	2.1458		1.7725	1.7725	3.6965	2.5070	2.5070
H4	1.0906	2.1583	1.7725		1.7683	2.9349	2.5093	3.0710
H5	1.0906	2.1583	1.7725	1.7683		2.9349	3.0710	2.5093
Cl6	2.7276	1.7892	3.6965	2.9349	2.9349		2.3483	2.3483
H7	2.1654	1.0894	2.5070	2.5093	3.0710	2.3483		1.7726
H8	2.1654	1.0894	2.5070	3.0710	2.5093	2.3483	1.7726

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	111.058	C1	C2	H7	111.529
C1	C2	H8	111.529	C2	C1	H3	109.712
C2	C1	H4	110.878	C2	C1	H5	110.878
H3	C1	H4	108.490	H3	C1	H5	108.490
H4	C1	H5	108.321	Cl6	C2	H7	106.798
Cl6	C2	H8	106.798	H7	C2	H8	108.900

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

using model chemistry: MP2=FULL/6-311G*

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: MP2=FULL/6-311G*

States and conformations

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