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	hartrees
Energy at 0K	-381.007984
Energy at 298.15K	-381.013077
HF Energy	-380.692549
Nuclear repulsion energy	190.741097

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3490	3490	14.23
2	A₁	1341	1341	205.55
3	A₁	872	872	268.83
4	A₁	671	671	137.25
5	A₁	436	436	0.07
6	A₂	116	116	0.00
7	E	3611	3611	47.38
7	E	3611	3611	47.37
8	E	1668	1668	28.48
8	E	1668	1668	28.47
9	E	1253	1253	371.29
9	E	1253	1253	371.37
10	E	808	808	0.54
10	E	808	808	0.55
11	E	446	446	1.12
11	E	446	446	1.12
12	E	273	273	10.33
12	E	273	273	10.33

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	1.469
B2	0.000	0.000	-0.219
F3	0.000	1.333	-0.543
F4	1.155	-0.667	-0.543
F5	-1.155	-0.667	-0.543
H6	0.000	-0.953	1.821
H7	0.825	0.477	1.821
H8	-0.825	0.477	1.821

	N1	B2	F3	F4	F5	H6	H7	H8
N1		1.6889	2.4137	2.4137	2.4137	1.0159	1.0159	1.0159
B2	1.6889		1.3718	1.3717	1.3717	2.2519	2.2519	2.2519
F3	2.4137	1.3718		2.3090	2.3090	3.2884	2.6460	2.6460
F4	2.4137	1.3717	2.3090		2.3090	2.6460	2.6460	3.2884
F5	2.4137	1.3717	2.3090	2.3090		2.6460	3.2884	2.6460
H6	1.0159	2.2519	3.2884	2.6460	2.6460		1.6510	1.6510
H7	1.0159	2.2519	2.6460	2.6460	3.2884	1.6510		1.6510
H8	1.0159	2.2519	2.6460	3.2884	2.6460	1.6510	1.6510

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B2	F3	103.628	N1	B2	F4	103.628
N1	B2	F5	103.628	B2	N1	H6	110.234
B2	N1	H7	110.234	B2	N1	H8	110.234
F3	B2	F4	114.628	F3	B2	F5	114.628
F4	B2	F5	114.628	H6	N1	H7	108.697
H6	N1	H8	108.697	H7	N1	H8	108.697

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)

using model chemistry: B2PLYP=FULL/6-311G**

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: B2PLYP=FULL/6-311G**

States and conformations

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)