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	hartrees
Energy at 0K	-380.188523
Energy at 298.15K	-380.193754
HF Energy	-379.410916
Nuclear repulsion energy	190.703573

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3484	3298	19.08
2	A₁	1422	1345	249.39
3	A₁	922	873	283.67
4	A₁	701	663	102.80
5	A₁	464	439	3.54
6	A₂	151	143	0.00
7	E	3613	3420	46.16
7	E	3613	3420	46.16
8	E	1722	1629	33.31
8	E	1722	1629	33.31
9	E	1328	1257	372.95
9	E	1328	1257	372.96
10	E	849	803	2.27
10	E	849	803	2.27
11	E	457	432	0.86
11	E	457	432	0.86
12	E	276	262	12.15
12	E	276	262	12.15

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	1.461
B2	0.000	0.000	-0.215
F3	0.000	1.335	-0.541
F4	1.156	-0.668	-0.541
F5	-1.156	-0.668	-0.541
H6	0.000	-0.956	1.820
H7	0.828	0.478	1.820
H8	-0.828	0.478	1.820

	N1	B2	F3	F4	F5	H6	H7	H8
N1		1.6759	2.4067	2.4067	2.4067	1.0214	1.0214	1.0214
B2	1.6759		1.3745	1.3745	1.3745	2.2482	2.2482	2.2482
F3	2.4067	1.3745		2.3125	2.3125	3.2903	2.6450	2.6450
F4	2.4067	1.3745	2.3125		2.3125	2.6450	2.6450	3.2903
F5	2.4067	1.3745	2.3125	2.3125		2.6450	3.2903	2.6450
H6	1.0214	2.2482	3.2903	2.6450	2.6450		1.6563	1.6563
H7	1.0214	2.2482	2.6450	2.6450	3.2903	1.6563		1.6563
H8	1.0214	2.2482	2.6450	3.2903	2.6450	1.6563	1.6563

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	B2	F3	103.744	N1	B2	F4	103.744
N1	B2	F5	103.744	B2	N1	H6	110.571
B2	N1	H7	110.571	B2	N1	H8	110.571
F3	B2	F4	114.540	F3	B2	F5	114.540
F4	B2	F5	114.540	H6	N1	H7	108.350
H6	N1	H8	108.350	H7	N1	H8	108.349

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)

using model chemistry: CCD/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: CCD/6-31G*

States and conformations

All results from a given calculation for NH₃BF₃ (Amminetrifluoroboron)