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	hartrees
Energy at 0K	-676.724912
Energy at 298.15K
HF Energy	-676.724912
Nuclear repulsion energy	139.700883

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	1338	1182	247.17	1.26	0.08	0.16
2	A₁	717	633	45.46	3.06	0.10	0.18
3	A₁	436	385	1.81	1.70	0.58	0.73
4	B₁	576	509	35.94	0.46	0.75	0.86
5	B₂	1662	1467	176.03	0.10	0.75	0.86
6	B₂	352	311	6.86	1.84	0.75	0.86

Atom	y (Å)	z (Å)
B1	0.000	-0.479
Cl2	0.000	1.330
F3	1.144	-1.123
F4	-1.144	-1.123

	B1	Cl2	F3	F4
B1		1.8092	1.3127	1.3127
Cl2	1.8092		2.7066	2.7066
F3	1.3127	2.7066		2.2882
F4	1.3127	2.7066	2.2882

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	B1	F3	119.362		Cl2	B1	F4	119.362
F3	B1	F4	121.276

All results from a given calculation for BClF₂ (Chlorodifluoroborane)

using model chemistry: B1B95/STO-3G

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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Number	Element	Mulliken
1	B	0.434
2	Cl	-0.251
3	F	-0.092
4	F	-0.092

	x	y	z	Total
	0.000	0.000	-2.012	2.012
CHELPG
AIM
ESP

<r²>	93.276
(<r²>)^1/2	9.658

All results from a given calculation for BClF2 (Chlorodifluoroborane)

using model chemistry: B1B95/STO-3G

States and conformations

All results from a given calculation for BClF₂ (Chlorodifluoroborane)