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	hartrees
Energy at 0K	-56.150716
Energy at 298.15K
HF Energy	-56.150716
Nuclear repulsion energy	11.675445

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3389	3358	0.00
2	A_g	3193	3164	0.00
3	A_g	1711	1696	0.00
4	A_g	1045	1036	0.00
5	A_g	621	615	0.00
6	A_g	245	243	0.00
7	A_u	3442	3411	4.17
8	A_u	1747	1731	26.14
9	A_u	390	386	89.36
10	A_u	171	169	45.80
11	B_g	3441	3410	0.00
12	B_g	1732	1716	0.00
13	B_g	251	249	0.00
14	B_u	3390	3359	36.08
15	B_u	3226	3196	203.62
16	B_u	1667	1651	10.58
17	B_u	848	840	480.66
18	B_u	215	213	460.08

Atom	x (Å)	y (Å)	z (Å)
H1	0.646	0.603	0.000
N2	0.000	1.417	0.000
N3	0.000	-1.417	0.000
H4	0.147	1.996	0.842
H5	0.147	1.996	-0.842
H6	-0.646	-0.603	0.000
H7	-0.147	-1.996	-0.842
H8	-0.147	-1.996	0.842

	H1	N2	N3	H4	H5	H6	H7	H8
H1		1.0394	2.1210	1.7025	1.7025	1.7679	2.8446	2.8446
N2	1.0394		2.8342	1.0324	1.0324	2.1210	3.5182	3.5182
N3	2.1210	2.8342		3.5182	3.5182	1.0394	1.0324	1.0324
H4	1.7025	1.0324	3.5182		1.6849	2.8446	4.3422	4.0020
H5	1.7025	1.0324	3.5182	1.6849		2.8446	4.0020	4.3422
H6	1.7679	2.1210	1.0394	2.8446	2.8446		1.7025	1.7025
H7	2.8446	3.5182	1.0324	4.3422	4.0020	1.7025		1.6849
H8	2.8446	3.5182	1.0324	4.0020	4.3422	1.7025	1.6849

Number	Element	Mulliken
1	H	0.285
2	N	-0.800
3	N	-0.800
4	H	0.257
5	H	0.257
6	H	0.285
7	H	0.257
8	H	0.257

All results from a given calculation for NH₃NH₃ (Ammonia Dimer)

using model chemistry: PBEPBEultrafine_cp/3-21G

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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<r²>	56.156
(<r²>)^1/2	7.494

All results from a given calculation for NH3NH3 (Ammonia Dimer)

using model chemistry: PBEPBEultrafine_cp/3-21G

States and conformations

All results from a given calculation for NH₃NH₃ (Ammonia Dimer)