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	hartrees
Energy at 0K	-1057.674090
Energy at 298.15K	-1057.676119
HF Energy	-1056.849928
Nuclear repulsion energy	212.193388

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3212	3024	3.85
2	A'	1393	1312	18.78
3	A'	1186	1117	160.85
4	A'	766	721	35.31
5	A'	472	445	1.55
6	A'	285	269	0.20
7	A"	1308	1232	60.78
8	A"	856	806	212.51
9	A"	381	359	0.41

Atom	x (Å)	y (Å)	z (Å)
C1	-0.176	0.522	0.000
H2	-1.079	1.122	0.000
F3	0.901	1.307	0.000
Cl4	-0.176	-0.471	1.453
Cl5	-0.176	-0.471	-1.453

	C1	H2	F3	Cl4	Cl5
C1		1.0845	1.3330	1.7603	1.7603
H2	1.0845		1.9890	2.3380	2.3380
F3	1.3330	1.9890		2.5368	2.5368
Cl4	1.7603	2.3380	2.5368		2.9069
Cl5	1.7603	2.3380	2.5368	2.9069

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	110.303	H2	C1	Cl4	108.184
H2	C1	Cl5	108.184	F3	C1	Cl4	109.417
F3	C1	Cl5	109.417	Cl4	C1	Cl5	111.318

All results from a given calculation for CHFCl₂ (fluorodichloromethane)

using model chemistry: CCSD=FULL/6-31G(2df,p)

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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All results from a given calculation for CHFCl2 (fluorodichloromethane)

using model chemistry: CCSD=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for CHFCl₂ (fluorodichloromethane)