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	hartrees
Energy at 0K	-82.916052
Energy at 298.15K	-82.922967
HF Energy	-82.631944
Nuclear repulsion energy	40.646960

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3581	3327	7.20
2	A₁	2466	2291	71.24
3	A₁	1435	1333	150.21
4	A₁	1216	1130	117.13
5	A₁	679	631	15.25
6	A₂	283	263	0.00
7	E	3690	3429	30.99
7	E	3690	3429	30.99
8	E	2526	2347	261.79
8	E	2526	2347	261.79
9	E	1776	1650	35.13
9	E	1776	1650	35.13
10	E	1209	1123	3.41
10	E	1209	1123	3.41
11	E	1110	1031	45.42
11	E	1110	1031	45.42
12	E	681	633	0.92
12	E	681	633	0.92

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-0.927
N2	0.000	0.000	0.728
H3	0.000	-1.171	-1.242
H4	-1.014	0.585	-1.242
H5	1.014	0.585	-1.242
H6	0.000	0.945	1.086
H7	-0.818	-0.472	1.086
H8	0.818	-0.472	1.086

	B1	N2	H3	H4	H5	H6	H7	H8
B1		1.6551	1.2126	1.2126	1.2126	2.2239	2.2239	2.2239
N2	1.6551		2.2918	2.2918	2.2918	1.0105	1.0105	1.0105
H3	1.2126	2.2918		2.0282	2.0282	3.1460	2.5647	2.5647
H4	1.2126	2.2918	2.0282		2.0282	2.5647	2.5647	3.1460
H5	1.2126	2.2918	2.0282	2.0282		2.5647	3.1460	2.5647
H6	2.2239	1.0105	3.1460	2.5647	2.5647		1.6367	1.6367
H7	2.2239	1.0105	2.5647	2.5647	3.1460	1.6367		1.6367
H8	2.2239	1.0105	2.5647	3.1460	2.5647	1.6367	1.6367

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	N2	H6	110.753	B1	N2	H7	110.753
B1	N2	H8	110.753	N2	B1	H3	105.055
N2	B1	H4	105.055	N2	B1	H5	105.055
H3	B1	H4	113.503	H3	B1	H5	113.503
H4	B1	H5	113.503	H6	N2	H7	108.160
H6	N2	H8	108.160	H7	N2	H8	108.160

All results from a given calculation for BH₃NH₃ (borane ammonia)

using model chemistry: CID/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 BH3NH3 (borane ammonia)

using model chemistry: CID/6-311G*

States and conformations

All results from a given calculation for BH₃NH₃ (borane ammonia)