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	hartrees
Energy at 0K	-2810.626416
Energy at 298.15K
HF Energy	-2809.819401
Nuclear repulsion energy	256.911003

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3173	3056
2	A'	1336	1287
3	A'	1123	1081
4	A'	717	691
5	A'	587	565
6	A'	322	310
7	A"	1405	1353
8	A"	1156	1114
9	A"	316	304

Atom	x (Å)	y (Å)	z (Å)
C1	-0.426	-0.916	0.000
H2	-1.511	-0.988	0.000
Br3	0.077	0.968	0.000
F4	0.077	-1.522	1.089
F5	0.077	-1.522	-1.089

	C1	H2	Br3	F4	F5
C1		1.0875	1.9504	1.3433	1.3433
H2	1.0875		2.5191	1.9978	1.9978
Br3	1.9504	2.5191		2.7178	2.7178
F4	1.3433	1.9978	2.7178		2.1774
F5	1.3433	1.9978	2.7178	2.1774

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Br3	108.686	H2	C1	F4	110.099
H2	C1	F5	110.099	Br3	C1	F4	109.833
Br3	C1	F5	109.833	F4	C1	F5	108.284

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

using model chemistry: QCISD(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: QCISD(T)/TZVP

States and conformations

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