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	hartrees
Energy at 0K	-538.568534
Energy at 298.15K
HF Energy	-538.140370
Nuclear repulsion energy	103.041646

Atom	x (Å)	y (Å)	z (Å)
C1	1.506	0.649	0.000
C2	0.000	0.808	0.000
H3	1.974	1.635	0.000
H4	1.839	0.108	0.883
H5	1.839	0.108	-0.883
Cl6	-0.824	-0.781	0.000
H7	-0.343	1.340	0.884
H8	-0.343	1.340	-0.884

	C1	C2	H3	H4	H5	Cl6	H7	H8
C1		1.5143	1.0908	1.0883	1.0883	2.7335	2.1623	2.1623
C2	1.5143		2.1397	2.1571	2.1571	1.7894	1.0872	1.0872
H3	1.0908	2.1397		1.7690	1.7690	3.6958	2.4964	2.4964
H4	1.0883	2.1571	1.7690		1.7667	2.9430	2.5058	3.0662
H5	1.0883	2.1571	1.7690	1.7667		2.9430	3.0662	2.5058
Cl6	2.7335	1.7894	3.6958	2.9430	2.9430		2.3477	2.3477
H7	2.1623	1.0872	2.4964	2.5058	3.0662	2.3477		1.7677
H8	2.1623	1.0872	2.4964	3.0662	2.5058	2.3477	1.7677

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl6	111.391	C1	C2	H7	111.385
C1	C2	H8	111.385	C2	C1	H3	109.366
C2	C1	H4	110.898	C2	C1	H5	110.898
H3	C1	H4	108.546	H3	C1	H5	108.546
H4	C1	H5	108.521	Cl6	C2	H7	106.843
Cl6	C2	H8	106.843	H7	C2	H8	108.774

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

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 CH3CH2Cl (Ethyl chloride)

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

States and conformations

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