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	hartrees
Energy at 0K	-499.446950
Energy at 298.15K
HF Energy	-499.119030
Nuclear repulsion energy	51.022745

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3079	3079
2	A₁	1381	1381
3	A₁	749	749
4	E	3189	3189
4	E	3188	3188
5	E	1476	1476
5	E	1476	1476
6	E	1027	1027
6	E	1027	1027

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.128
Cl2	0.000	0.000	0.660
H3	0.000	1.043	-1.484
H4	0.903	-0.521	-1.484
H5	-0.903	-0.521	-1.484

	C1	Cl2	H3	H4	H5
C1		1.7885	1.1016	1.1016	1.1016
Cl2	1.7885		2.3843	2.3843	2.3843
H3	1.1016	2.3843		1.8058	1.8058
H4	1.1016	2.3843	1.8058		1.8058
H5	1.1016	2.3843	1.8058	1.8058

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.840	Cl2	C1	H4	108.840
Cl2	C1	H5	108.840	H3	C1	H4	110.095
H3	C1	H5	110.095	H4	C1	H5	110.095

All results from a given calculation for CH₃Cl (Methyl chloride)

using model chemistry: CCSD(T)/cc-pV(D+d)Z

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 CH3Cl (Methyl chloride)

using model chemistry: CCSD(T)/cc-pV(D+d)Z

States and conformations

All results from a given calculation for CH₃Cl (Methyl chloride)