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	hartrees
Energy at 0K	-497.021226
Energy at 298.15K	-497.024190
HF Energy	-496.794660
Nuclear repulsion energy	50.700521

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3135	2982	15.20	88.26	0.01	0.03
2	A₁	1475	1403	11.18	4.23	0.57	0.73
3	A₁	702	668	26.03	16.16	0.32	0.49
4	E	3233	3076	4.55	51.03	0.75	0.86
4	E	3233	3076	4.55	51.03	0.75	0.86
5	E	1586	1508	7.60	20.34	0.75	0.86
5	E	1586	1508	7.60	20.34	0.75	0.86
6	E	1085	1032	4.71	8.33	0.75	0.86
6	E	1085	1032	4.71	8.33	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.146
Cl2	0.000	0.000	0.667
H3	0.000	1.034	-1.487
H4	0.895	-0.517	-1.487
H5	-0.895	-0.517	-1.487

	C1	Cl2	H3	H4	H5
C1		1.8133	1.0884	1.0884	1.0884
Cl2	1.8133		2.3891	2.3891	2.3891
H3	1.0884	2.3891		1.7905	1.7905
H4	1.0884	2.3891	1.7905		1.7905
H5	1.0884	2.3891	1.7905	1.7905

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.234	Cl2	C1	H4	108.234
Cl2	C1	H5	108.234	H3	C1	H4	110.680
H3	C1	H5	110.680	H4	C1	H5	110.680

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

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