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	hartrees
Energy at 0K	-499.512396
Energy at 298.15K	-499.515388
HF Energy	-499.147890
Nuclear repulsion energy	51.545018

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3163	2930	23.04
2	A₁	1435	1330	14.14
3	A₁	778	721	26.87
4	E	3265	3025	5.27
4	E	3265	3025	5.27
5	E	1538	1425	5.42
5	E	1538	1425	5.42
6	E	1067	989	2.16
6	E	1067	989	2.16

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.123
Cl2	0.000	0.000	0.655
H3	0.000	1.023	-1.466
H4	0.886	-0.512	-1.466
H5	-0.886	-0.512	-1.466

	C1	Cl2	H3	H4	H5
C1		1.7776	1.0793	1.0793	1.0793
Cl2	1.7776		2.3552	2.3552	2.3552
H3	1.0793	2.3552		1.7719	1.7719
H4	1.0793	2.3552	1.7719		1.7719
H5	1.0793	2.3552	1.7719	1.7719

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.580	Cl2	C1	H4	108.580
Cl2	C1	H5	108.580	H3	C1	H4	110.348
H3	C1	H5	110.348	H4	C1	H5	110.348

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

using model chemistry: CID/cc-pVTZ

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: CID/cc-pVTZ

States and conformations

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