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	hartrees
Energy at 0K	-3627.349254
Energy at 298.15K	-3627.352986
HF Energy	-3626.317173
Nuclear repulsion energy	532.654243

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1144	1075	141.80	1.31	0.58	0.73
2	A'	853	802	221.79	2.43	0.71	0.83
3	A'	521	489	1.40	9.09	0.01	0.02
4	A'	356	335	0.15	1.89	0.75	0.86
5	A'	322	303	0.08	4.08	0.21	0.34
6	A'	228	214	0.01	2.02	0.66	0.79
7	A"	861	809	218.28	2.69	0.75	0.86
8	A"	405	380	0.02	2.24	0.75	0.86
9	A"	214	201	0.02	1.77	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.504	0.137	0.000
Br2	-1.373	0.319	0.000
F3	1.047	1.353	0.000
Cl4	1.047	-0.711	1.440
Cl5	1.047	-0.711	-1.440

	C1	Br2	F3	Cl4	Cl5
C1		1.8856	1.3319	1.7571	1.7571
Br2	1.8856		2.6311	2.9980	2.9980
F3	1.3319	2.6311		2.5168	2.5168
Cl4	1.7571	2.9980	2.5168		2.8808
Cl5	1.7571	2.9980	2.5168	2.8808

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Br2	C1	F3	108.496	Br2	C1	Cl4	110.726
Br2	C1	Cl5	110.726	F3	C1	Cl4	108.344
F3	C1	Cl5	108.344	Cl4	C1	Cl5	110.125

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)

using model chemistry: MP2=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 CBrCl2F (bromodichlorofluoromethane)

using model chemistry: MP2=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for CBrCl₂F (bromodichlorofluoromethane)