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	hartrees
Energy at 0K	-599.327418
Energy at 298.15K	-599.330081
Nuclear repulsion energy	101.225943

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3085	2967	23.03
2	A'	1498	1441	0.26
3	A'	1369	1317	31.09
4	A'	1104	1061	172.38
5	A'	748	719	97.52
6	A'	383	368	1.06
7	A"	3161	3040	9.15
8	A"	1256	1208	2.49
9	A"	1006	968	0.41

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.806	0.000
F2	1.355	0.764	0.000
Cl3	-0.676	-0.842	0.000
H4	-0.347	1.300	0.904
H5	-0.347	1.300	-0.904

	C1	F2	Cl3	H4	H5
C1		1.3554	1.7805	1.0879	1.0879
F2	1.3554		2.5887	2.0009	2.0009
Cl3	1.7805	2.5887		2.3481	2.3481
H4	1.0879	2.0009	2.3481		1.8089
H5	1.0879	2.0009	2.3481	1.8089

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	110.551	F2	C1	H4	109.468
F2	C1	H5	109.468	Cl3	C1	H4	107.422
Cl3	C1	H5	107.422	H4	C1	H5	112.478

All results from a given calculation for CH₂FCl (fluorochloromethane)

using model chemistry: B3PW91/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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Number	Element	Mulliken
1	C	0.175
2	F	-0.184
3	Cl	-0.149
4	H	0.079
5	H	0.079

	x	y	z	Total
	-0.886	1.587	0.000	1.818
CHELPG
AIM
ESP

	x	y	z
x	3.547	0.706	0.000
y	0.706	4.549	0.000
z	0.000	0.000	3.018

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2FCl (fluorochloromethane)

using model chemistry: B3PW91/cc-pVTZ

States and conformations

All results from a given calculation for CH₂FCl (fluorochloromethane)