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	hartrees
Energy at 0K	-499.571447
Energy at 298.15K	-499.574414
HF Energy	-499.148928
Nuclear repulsion energy	51.285468

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3077	3077
2	A₁	1385	1385
3	A₁	746	746
4	E	3179	3179
4	E	3179	3179
5	E	1494	1494
5	E	1493	1493
6	E	1031	1031
6	E	1031	1031

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.128
Cl2	0.000	0.000	0.658
H3	0.000	1.030	-1.473
H4	0.892	-0.515	-1.473
H5	-0.892	-0.515	-1.473

	C1	Cl2	H3	H4	H5
C1		1.7860	1.0861	1.0861	1.0861
Cl2	1.7860		2.3667	2.3667	2.3667
H3	1.0861	2.3667		1.7838	1.7838
H4	1.0861	2.3667	1.7838		1.7838
H5	1.0861	2.3667	1.7838	1.7838

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.514	Cl2	C1	H4	108.514
Cl2	C1	H5	108.514	H3	C1	H4	110.411
H3	C1	H5	110.411	H4	C1	H5	110.411

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

using model chemistry: QCISD(T)/cc-pCVTZ

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: QCISD(T)/cc-pCVTZ

States and conformations

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