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	hartrees
Energy at 0K	-45.914911
Energy at 298.15K	-45.917464
Nuclear repulsion energy	38.686583

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3128	3029	33.86
2	A'	1473	1426	0.04
3	A'	1353	1311	39.94
4	A'	997	965	161.30
5	A'	684	662	98.64
6	A'	344	333	2.41
7	A"	3242	3140	24.07
8	A"	1198	1160	3.17
9	A"	973	942	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.853	0.000
F2	1.423	0.788	0.000
Cl3	-0.715	-0.876	0.000
H4	-0.328	1.343	0.924
H5	-0.328	1.343	-0.924

	C1	F2	Cl3	H4	H5
C1		1.4242	1.8710	1.0965	1.0965
F2	1.4242		2.7092	2.0561	2.0561
Cl3	1.8710	2.7092		2.4352	2.4352
H4	1.0965	2.0561	2.4352		1.8481
H5	1.0965	2.0561	2.4352	1.8481

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	109.860	F2	C1	H4	108.619
F2	C1	H5	108.619	Cl3	C1	H4	107.406
Cl3	C1	H5	107.406	H4	C1	H5	114.867

All results from a given calculation for CH₂FCl (fluorochloromethane)

using model chemistry: B3LYP/CEP-31G

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	-0.235
2	F	-0.196
3	Cl	-0.041
4	H	0.236
5	H	0.236

	x	y	z	Total
	-1.496	2.160	0.000	2.628
CHELPG
AIM
ESP

	x	y	z
x	2.610	1.197	0.000
y	1.197	4.137	0.000
z	0.000	0.000	1.645

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2FCl (fluorochloromethane)

using model chemistry: B3LYP/CEP-31G

States and conformations

All results from a given calculation for CH₂FCl (fluorochloromethane)