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	hartrees
Energy at 0K	-1058.946986
Energy at 298.15K	-1058.948980
HF Energy	-1058.946986
Nuclear repulsion energy	210.604260

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3178	3040	7.29
2	A'	1350	1291	23.09
3	A'	1128	1079	220.17
4	A'	746	714	48.62
5	A'	465	445	1.82
6	A'	286	274	0.06
7	A"	1286	1231	69.31
8	A"	809	774	283.34
9	A"	376	360	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	-0.175	0.519	0.000
H2	-1.081	1.119	0.000
F3	0.900	1.318	0.000
Cl4	-0.175	-0.473	1.470
Cl5	-0.175	-0.473	-1.470

	C1	H2	F3	Cl4	Cl5
C1		1.0865	1.3396	1.7737	1.7737
H2	1.0865		1.9906	2.3491	2.3491
F3	1.3396	1.9906		2.5547	2.5547
Cl4	1.7737	2.3491	2.5547		2.9401
Cl5	1.7737	2.3491	2.5547	2.9401

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.828	H2	C1	Cl4	108.010
H2	C1	Cl5	108.010	F3	C1	Cl4	109.500
F3	C1	Cl5	109.500	Cl4	C1	Cl5	111.956

All results from a given calculation for CHFCl₂ (fluorodichloromethane)

using model chemistry: wB97X-D/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	0.007
2	H	0.213
3	F	-0.174
4	Cl	-0.023
5	Cl	-0.023

	x	y	z	Total
	-1.273	0.709	0.000	1.457
CHELPG
AIM
ESP

	x	y	z
x	2.979	0.143	0.000
y	0.143	4.100	0.000
z	0.000	0.000	6.456

<r²>	131.947
(<r²>)^1/2	11.487

All results from a given calculation for CHFCl2 (fluorodichloromethane)

using model chemistry: wB97X-D/6-311G**

States and conformations

All results from a given calculation for CHFCl₂ (fluorodichloromethane)