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	hartrees
Energy at 0K	-2810.625237
Energy at 298.15K
HF Energy	-2809.819494
Nuclear repulsion energy	257.030444

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3173	3054
2	A'	1338	1288
3	A'	1126	1084
4	A'	719	692
5	A'	588	566
6	A'	323	311
7	A"	1408	1355
8	A"	1160	1116
9	A"	316	305

Atom	x (Å)	y (Å)	z (Å)
C1	-0.425	-0.916	0.000
H2	-1.510	-0.988	0.000
Br3	0.077	0.968	0.000
F4	0.077	-1.521	1.088
F5	0.077	-1.521	-1.088

	C1	H2	Br3	F4	F5
C1		1.0875	1.9496	1.3425	1.3425
H2	1.0875		2.5189	1.9968	1.9968
Br3	1.9496	2.5189		2.7165	2.7165
F4	1.3425	1.9968	2.7165		2.1764
F5	1.3425	1.9968	2.7165	2.1764

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	108.729	H2	C1	F4	110.068
H2	C1	F5	110.068	Br3	C1	F4	109.835
Br3	C1	F5	109.835	F4	C1	F5	108.298

All results from a given calculation for CHBrF₂ (Methane, bromodifluoro-)

using model chemistry: CCSD(T)/TZVP

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 CHBrF2 (Methane, bromodifluoro-)

using model chemistry: CCSD(T)/TZVP

States and conformations

All results from a given calculation for CHBrF₂ (Methane, bromodifluoro-)