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	hartrees
Energy at 0K	-380.084459
Energy at 298.15K	-380.089754
HF Energy	-379.412001
Nuclear repulsion energy	191.677989

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3595	3321	24.44
2	A₁	1455	1344	265.29
3	A₁	936	865	292.67
4	A₁	710	656	119.08
5	A₁	469	434	2.50
6	A₂	154	142	0.00
7	E	3725	3441	58.46
7	E	3725	3441	58.46
8	E	1763	1629	36.05
8	E	1763	1629	36.05
9	E	1349	1246	393.78
9	E	1349	1246	393.79
10	E	866	800	2.36
10	E	866	800	2.36
11	E	465	430	1.00
11	E	465	430	1.00
12	E	283	262	12.28
12	E	283	262	12.28

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	1.458
B2	0.000	0.000	-0.214
F3	0.000	1.327	-0.540
F4	1.150	-0.664	-0.540
F5	-1.150	-0.664	-0.540
H6	0.000	-0.949	1.812
H7	0.822	0.475	1.812
H8	-0.822	0.475	1.812

	N1	B2	F3	F4	F5	H6	H7	H8
N1		1.6718	2.3983	2.3983	2.3983	1.0132	1.0132	1.0132
B2	1.6718		1.3668	1.3668	1.3668	2.2376	2.2376	2.2376
F3	2.3983	1.3668		2.2991	2.2991	3.2733	2.6334	2.6334
F4	2.3983	1.3668	2.2991		2.2991	2.6334	2.6334	3.2733
F5	2.3983	1.3668	2.2991	2.2991		2.6334	3.2733	2.6334
H6	1.0132	2.2376	3.2733	2.6334	2.6334		1.6439	1.6439
H7	1.0132	2.2376	2.6334	2.6334	3.2733	1.6439		1.6439
H8	1.0132	2.2376	2.6334	3.2733	2.6334	1.6439	1.6439

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B2	F3	103.784	N1	B2	F4	103.784
N1	B2	F5	103.784	B2	N1	H6	110.484
B2	N1	H7	110.484	B2	N1	H8	110.484
F3	B2	F4	114.510	F3	B2	F5	114.510
F4	B2	F5	114.509	H6	N1	H7	108.440
H6	N1	H8	108.440	H7	N1	H8	108.440

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)

using model chemistry: CID/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 NH3BF3 (Amminetrifluoroboron)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)