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	hartrees
Energy at 0K	-83.001521
Energy at 298.15K	-83.008408
HF Energy	-82.643145
Nuclear repulsion energy	40.518021

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3479	3374
2	A₁	2458	2384
3	A₁	1361	1319
4	A₁	1216	1179
5	A₁	676	656
6	A₂	285	276
7	E	3597	3488
7	E	3597	3488
8	E	2520	2444
8	E	2520	2444
9	E	1670	1619
9	E	1669	1618
10	E	1219	1182
10	E	1219	1182
11	E	1084	1051
11	E	1084	1051
12	E	654	634
12	E	654	634

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-0.931
N2	0.000	0.000	0.727
H3	0.000	-1.173	-1.238
H4	-1.016	0.586	-1.238
H5	1.016	0.586	-1.238
H6	0.000	0.950	1.094
H7	-0.823	-0.475	1.094
H8	0.823	-0.475	1.094

	B1	N2	H3	H4	H5	H6	H7	H8
B1		1.6582	1.2121	1.2121	1.2121	2.2373	2.2373	2.2373
N2	1.6582		2.2881	2.2881	2.2881	1.0187	1.0187	1.0187
H3	1.2121	2.2881		2.0312	2.0312	3.1536	2.5695	2.5695
H4	1.2121	2.2881	2.0312		2.0312	2.5695	2.5695	3.1536
H5	1.2121	2.2881	2.0312	2.0312		2.5695	3.1536	2.5695
H6	2.2373	1.0187	3.1536	2.5695	2.5695		1.6457	1.6457
H7	2.2373	1.0187	2.5695	2.5695	3.1536	1.6457		1.6457
H8	2.2373	1.0187	2.5695	3.1536	2.5695	1.6457	1.6457

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	N2	H6	111.136	B1	N2	H7	111.136
B1	N2	H8	111.136	N2	B1	H3	104.651
N2	B1	H4	104.651	N2	B1	H5	104.651
H3	B1	H4	113.831	H3	B1	H5	113.831
H4	B1	H5	113.831	H6	N2	H7	107.757
H6	N2	H8	107.757	H7	N2	H8	107.757

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

using model chemistry: MP4/6-311G**

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: MP4/6-311G**

States and conformations

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