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	hartrees
Energy at 0K	-1058.971751
Energy at 298.15K	-1058.973704
Nuclear repulsion energy	210.939600

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3174	3031	7.53
2	A'	1347	1286	24.74
3	A'	1161	1109	190.13
4	A'	744	711	48.41
5	A'	459	439	2.33
6	A'	278	265	0.28
7	A"	1274	1217	65.93
8	A"	798	762	275.39
9	A"	367	350	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	-0.177	0.521	0.000
H2	-1.081	1.127	0.000
F3	0.907	1.308	0.000
Cl4	-0.177	-0.471	1.467
Cl5	-0.177	-0.471	-1.467

	C1	H2	F3	Cl4	Cl5
C1		1.0879	1.3395	1.7710	1.7710
H2	1.0879		1.9962	2.3499	2.3499
F3	1.3395	1.9962		2.5479	2.5479
Cl4	1.7710	2.3499	2.5479		2.9333
Cl5	1.7710	2.3499	2.5479	2.9333

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.215	H2	C1	Cl4	108.180
H2	C1	Cl5	108.180	F3	C1	Cl4	109.216
F3	C1	Cl5	109.216	Cl4	C1	Cl5	111.821

All results from a given calculation for CHFCl₂ (fluorodichloromethane)

using model chemistry: B1B95/6-31G**

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	-0.012
2	H	0.210
3	F	-0.225
4	Cl	0.014
5	Cl	0.014

	x	y	z	Total
	-1.129	0.790	0.000	1.378
CHELPG
AIM
ESP

	x	y	z
x	3.185	0.130	0.000
y	0.130	4.110	0.000
z	0.000	0.000	6.240

<r²>	131.038
(<r²>)^1/2	11.447

All results from a given calculation for CHFCl2 (fluorodichloromethane)

using model chemistry: B1B95/6-31G**

States and conformations

All results from a given calculation for CHFCl₂ (fluorodichloromethane)