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	hartrees
Energy at 0K	-380.429454
Energy at 298.15K	-380.434635
HF Energy	-379.511540
Nuclear repulsion energy	190.788280

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3483	3353
2	A₁	1400	1348
3	A₁	886	853
4	A₁	687	661
5	A₁	453	436
6	A₂	139	134
7	E	3603	3469
7	E	3603	3469
8	E	1728	1664
8	E	1727	1663
9	E	1270	1223
9	E	1270	1223
10	E	831	801
10	E	831	800
11	E	450	434
11	E	450	434
12	E	277	267
12	E	277	266

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	1.464
B2	0.000	0.000	-0.216
F3	0.000	1.334	-0.541
F4	1.156	-0.667	-0.541
F5	-1.156	-0.667	-0.541
H6	0.000	-0.955	1.814
H7	0.827	0.478	1.814
H8	-0.827	0.478	1.814

	N1	B2	F3	F4	F5	H6	H7	H8
N1		1.6802	2.4086	2.4086	2.4086	1.0174	1.0174	1.0174
B2	1.6802		1.3735	1.3735	1.3735	2.2440	2.2440	2.2440
F3	2.4086	1.3735		2.3114	2.3114	3.2849	2.6395	2.6395
F4	2.4086	1.3735	2.3114		2.3114	2.6395	2.6395	3.2849
F5	2.4086	1.3735	2.3114	2.3114		2.6395	3.2849	2.6395
H6	1.0174	2.2440	3.2849	2.6395	2.6395		1.6545	1.6545
H7	1.0174	2.2440	2.6395	2.6395	3.2849	1.6545		1.6545
H8	1.0174	2.2440	2.6395	3.2849	2.6395	1.6545	1.6545

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B2	F3	103.686	N1	B2	F4	103.686
N1	B2	F5	103.686	B2	N1	H6	110.140
B2	N1	H7	110.140	B2	N1	H8	110.140
F3	B2	F4	114.584	F3	B2	F5	114.584
F4	B2	F5	114.584	H6	N1	H7	108.795
H6	N1	H8	108.795	H7	N1	H8	108.795

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)

using model chemistry: QCISD(T)/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: QCISD(T)/6-311G*

States and conformations

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)