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	hartrees
Energy at 0K	-599.376105
Energy at 298.15K	-599.378783
Nuclear repulsion energy	101.331301

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3113	2979	27.96
2	A'	1506	1441	0.66
3	A'	1390	1330	46.95
4	A'	1120	1072	184.13
5	A'	758	725	107.60
6	A'	390	373	1.32
7	A"	3193	3054	13.47
8	A"	1270	1215	3.97
9	A"	1017	973	0.11

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.807	0.000
F2	1.352	0.761	0.000
Cl3	-0.675	-0.841	0.000
H4	-0.347	1.301	0.905
H5	-0.347	1.301	-0.905

	C1	F2	Cl3	H4	H5
C1		1.3531	1.7803	1.0877	1.0877
F2	1.3531		2.5838	1.9994	1.9994
Cl3	1.7803	2.5838		2.3478	2.3478
H4	1.0877	1.9994	2.3478		1.8092
H5	1.0877	1.9994	2.3478	1.8092

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	110.354	F2	C1	H4	109.527
F2	C1	H5	109.527	Cl3	C1	H4	107.427
Cl3	C1	H5	107.427	H4	C1	H5	112.538

All results from a given calculation for CH₂FCl (fluorochloromethane)

using model chemistry: mPW1PW91/6-311G**

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	0.003
2	F	-0.221
3	Cl	-0.109
4	H	0.164
5	H	0.164

	x	y	z	Total
	-0.970	1.758	0.000	2.008
CHELPG
AIM
ESP

	x	y	z
x	2.879	0.813	0.000
y	0.813	4.155	0.000
z	0.000	0.000	2.367

<r²>	65.650
(<r²>)^1/2	8.102

All results from a given calculation for CH2FCl (fluorochloromethane)

using model chemistry: mPW1PW91/6-311G**

States and conformations

All results from a given calculation for CH₂FCl (fluorochloromethane)