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	hartrees
Energy at 0K	-137.170469
Energy at 298.15K
HF Energy	-136.634031
Nuclear repulsion energy	68.747104

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3772	3582	32.55
2	A₁	3656	3471	7.43
3	A₁	2651	2517	149.39
4	A₁	1638	1556	25.09
5	A₁	1200	1139	35.87
6	A₁	929	882	2.73
7	A₁	395	375	0.55
8	A₂	460	437	0.00
9	A₂	310	294	0.00
10	B₁	942	894	8.28
11	B₁	605	575	3.19
12	B₁	355	337	379.25
13	B₂	3773	3583	27.49
14	B₂	3656	3471	58.70
15	B₂	1642	1559	247.31
16	B₂	1441	1368	197.24
17	B₂	1110	1054	2.05
18	B₂	816	775	0.09

Atom	y (Å)	z (Å)
B1	0.000	0.501
H2	0.000	1.694
N3	1.241	-0.177
N4	-1.241	-0.177
H5	2.113	0.315
H6	1.341	-1.175
H7	-2.113	0.315
H8	-1.341	-1.175

	B1	H2	N3	N4	H5	H6	H7	H8
B1		1.1932	1.4144	1.4144	2.1213	2.1468	2.1213	2.1468
H2	1.1932		2.2457	2.2457	2.5236	3.1676	2.5236	3.1676
N3	1.4144	2.2457		2.4821	1.0012	1.0033	3.3900	2.7680
N4	1.4144	2.2457	2.4821		3.3900	2.7680	1.0012	1.0033
H5	2.1213	2.5236	1.0012	3.3900		1.6785	4.2261	3.7615
H6	2.1468	3.1676	1.0033	2.7680	1.6785		3.7615	2.6814
H7	2.1213	2.5236	3.3900	1.0012	4.2261	3.7615		1.6785
H8	2.1468	3.1676	2.7680	1.0033	3.7615	2.6814	1.6785

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	N3	H5	121.910	B1	N3	H6	124.364
B1	N4	H7	121.910	B1	N4	H8	124.364
H2	B1	N3	118.664	H2	B1	N4	118.664
N3	B1	N4	122.673	H5	N3	H6	113.726
H7	N4	H8	113.726

All results from a given calculation for NH₂BHNH₂ (diaminoborane)

using model chemistry: MP2/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 NH2BHNH2 (diaminoborane)

using model chemistry: MP2/cc-pVTZ

States and conformations

All results from a given calculation for NH₂BHNH₂ (diaminoborane)