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	hartrees
Energy at 0K	-499.568645
Energy at 298.15K	-499.571609
HF Energy	-499.148697
Nuclear repulsion energy	51.272597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3077	3077
2	A₁	1385	1385
3	A₁	746	746
4	E	3178	3178
4	E	3177	3177
5	E	1493	1493
5	E	1493	1493
6	E	1032	1032
6	E	1032	1032

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		1.7865	1.0863	1.0863	1.0863
Cl2	1.7865		2.3671	2.3671	2.3671
H3	1.0863	2.3671		1.7843	1.7843
H4	1.0863	2.3671	1.7843		1.7843
H5	1.0863	2.3671	1.7843	1.7843

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.499	Cl2	C1	H4	108.499
Cl2	C1	H5	108.499	H3	C1	H4	110.426
H3	C1	H5	110.426	H4	C1	H5	110.426

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

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

States and conformations

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