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	hartrees
Energy at 0K	-1047.098704
Energy at 298.15K	-1047.100424
Nuclear repulsion energy	202.749994

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3304	2918	0.50
2	A'	1392	1229	72.78
3	A'	1266	1117	59.27
4	A'	742	655	44.38
5	A'	452	399	7.94
6	A'	251	221	2.54
7	A"	1260	1113	52.26
8	A"	837	739	172.23
9	A"	352	311	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	-0.174	0.566	0.000
H2	-1.150	1.115	0.000
F3	0.900	1.397	0.000
Cl4	-0.174	-0.502	1.522
Cl5	-0.174	-0.502	-1.522

	C1	H2	F3	Cl4	Cl5
C1		1.1204	1.3578	1.8595	1.8595
H2	1.1204		2.0691	2.4261	2.4261
F3	1.3578	2.0691		2.6604	2.6604
Cl4	1.8595	2.4261	2.6604		3.0445
Cl5	1.8595	2.4261	2.6604	3.0445

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	112.872	H2	C1	Cl4	106.352
H2	C1	Cl5	106.352	F3	C1	Cl4	110.598
F3	C1	Cl5	110.598	Cl4	C1	Cl5	109.894

All results from a given calculation for CHFCl₂ (fluorodichloromethane)

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	0.123
2	H	0.145
3	F	-0.016
4	Cl	-0.126
5	Cl	-0.126

	x	y	z	Total
	-0.465	2.084	0.000	2.136
CHELPG
AIM
ESP

	x	y	z
x	1.095	0.256	0.000
y	0.256	2.095	0.000
z	0.000	0.000	3.813

<r²>	139.028
(<r²>)^1/2	11.791

All results from a given calculation for CHFCl2 (fluorodichloromethane)

using model chemistry: B1B95/STO-3G

States and conformations

All results from a given calculation for CHFCl₂ (fluorodichloromethane)