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	hartrees
Energy at 0K	-499.685751
Energy at 298.15K	-499.688734
HF Energy	-499.118466
Nuclear repulsion energy	51.128302

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3125	3125	22.94
2	A₁	1399	1399	15.73
3	A₁	772	772	22.51
4	E	3238	3238	6.84
4	E	3238	3238	6.84
5	E	1493	1493	4.82
5	E	1493	1493	4.82
6	E	1041	1041	2.65
6	E	1041	1041	2.65

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.127
Cl2	0.000	0.000	0.659
H3	0.000	1.038	-1.480
H4	0.899	-0.519	-1.480
H5	-0.899	-0.519	-1.480

	C1	Cl2	H3	H4	H5
C1		1.7865	1.0967	1.0967	1.0967
Cl2	1.7865		2.3782	2.3782	2.3782
H3	1.0967	2.3782		1.7985	1.7985
H4	1.0967	2.3782	1.7985		1.7985
H5	1.0967	2.3782	1.7985	1.7985

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.776	Cl2	C1	H4	108.776
Cl2	C1	H5	108.776	H3	C1	H4	110.158
H3	C1	H5	110.158	H4	C1	H5	110.158

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

using model chemistry: MP3=FULL/cc-pCVDZ

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: MP3=FULL/cc-pCVDZ

States and conformations

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