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	hartrees
Energy at 0K	-2708.804553
Energy at 298.15K	-2708.810020
HF Energy	-2708.345001
Nuclear repulsion energy	164.758749

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3194	2985	19.09
2	A'	1562	1459	0.82
3	A'	1393	1302	75.70
4	A'	1134	1059	158.27
5	A'	663	620	62.92
6	A'	316	295	0.54
7	A"	3290	3075	8.75
8	A"	1285	1201	2.92
9	A"	974	910	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.518	-1.116	0.000
F2	-0.589	-1.917	0.000
Br3	0.000	0.757	0.000
H4	1.095	-1.283	0.902
H5	1.095	-1.283	-0.902

	C1	F2	Br3	H4	H5
C1		1.3657	1.9440	1.0837	1.0837
F2	1.3657		2.7381	2.0124	2.0124
Br3	1.9440	2.7381		2.4851	2.4851
H4	1.0837	2.0124	2.4851		1.8041
H5	1.0837	2.0124	2.4851	1.8041

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Br3	110.423	F2	C1	H4	109.959
F2	C1	H5	109.959	Br3	C1	H4	106.863
Br3	C1	H5	106.863	H4	C1	H5	112.685

All results from a given calculation for CH₂BrF (Methane, bromofluoro-)

using model chemistry: MP2=FULL/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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All results from a given calculation for CH2BrF (Methane, bromofluoro-)

using model chemistry: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for CH₂BrF (Methane, bromofluoro-)