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	hartrees
Energy at 0K	-592.438024
Energy at 298.15K	-592.440585
Nuclear repulsion energy	97.795894

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3263	2881	3.71
2	A'	1618	1429	0.75
3	A'	1412	1247	43.83
4	A'	1252	1105	60.62
5	A'	785	693	58.50
6	A'	376	332	3.58
7	A"	3381	2985	2.49
8	A"	1278	1128	3.02
9	A"	1010	892	2.27

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.841	0.000
F2	1.372	0.848	0.000
Cl3	-0.677	-0.901	0.000
H4	-0.420	1.319	0.917
H5	-0.420	1.319	-0.917

	C1	F2	Cl3	H4	H5
C1		1.3725	1.8683	1.1165	1.1165
F2	1.3725		2.6939	2.0680	2.0680
Cl3	1.8683	2.6939		2.4154	2.4154
H4	1.1165	2.0680	2.4154		1.8346
H5	1.1165	2.0680	2.4154	1.8346

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	111.542	F2	C1	H4	111.963
F2	C1	H5	111.963	Cl3	C1	H4	105.244
Cl3	C1	H5	105.244	H4	C1	H5	110.480

All results from a given calculation for CH₂FCl (fluorochloromethane)

using model chemistry: B1B95/STO-3G

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	0.012
2	F	-0.053
3	Cl	-0.186
4	H	0.113
5	H	0.113

	x	y	z	Total
	0.180	2.298	0.000	2.305
CHELPG
AIM
ESP

	x	y	z
x	1.512	0.705	0.000
y	0.705	2.320	0.000
z	0.000	0.000	0.891

<r²>	68.470
(<r²>)^1/2	8.275

All results from a given calculation for CH2FCl (fluorochloromethane)

using model chemistry: B1B95/STO-3G

States and conformations

All results from a given calculation for CH₂FCl (fluorochloromethane)