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	hartrees
Energy at 0K	-83.062801
Energy at 298.15K	-83.069661
HF Energy	-82.652792
Nuclear repulsion energy	40.617408

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3470	3363
2	A₁	2453	2378
3	A₁	1339	1298
4	A₁	1207	1170
5	A₁	680	659
6	A₂	268	260
7	E	3590	3479
7	E	3590	3479
8	E	2515	2438
8	E	2515	2438
9	E	1677	1625
9	E	1676	1624
10	E	1212	1175
10	E	1212	1175
11	E	1077	1043
11	E	1077	1043
12	E	648	628
12	E	648	628

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-0.928
N2	0.000	0.000	0.726
H3	0.000	-1.169	-1.238
H4	-1.013	0.585	-1.238
H5	1.013	0.585	-1.238
H6	0.000	0.947	1.091
H7	-0.820	-0.474	1.091
H8	0.820	-0.474	1.091

	B1	N2	H3	H4	H5	H6	H7	H8
B1		1.6545	1.2097	1.2097	1.2097	2.2303	2.2303	2.2303
N2	1.6545		2.2862	2.2862	2.2862	1.0151	1.0151	1.0151
H3	1.2097	2.2862		2.0252	2.0252	3.1473	2.5656	2.5656
H4	1.2097	2.2862	2.0252		2.0252	2.5656	2.5656	3.1473
H5	1.2097	2.2862	2.0252	2.0252		2.5656	3.1473	2.5656
H6	2.2303	1.0151	3.1473	2.5656	2.5656		1.6409	1.6409
H7	2.2303	1.0151	2.5656	2.5656	3.1473	1.6409		1.6409
H8	2.2303	1.0151	2.5656	3.1473	2.5656	1.6409	1.6409

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	N2	H6	111.051	B1	N2	H7	111.051
B1	N2	H8	111.051	N2	B1	H3	104.855
N2	B1	H4	104.855	N2	B1	H5	104.855
H3	B1	H4	113.666	H3	B1	H5	113.666
H4	B1	H5	113.666	H6	N2	H7	107.846
H6	N2	H8	107.846	H7	N2	H8	107.846

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

using model chemistry: MP4/cc-pVTZ

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: MP4/cc-pVTZ

States and conformations

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