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	hartrees
Energy at 0K	-56.470451
Energy at 298.15K
HF Energy	-56.470451
Nuclear repulsion energy	11.778249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3466	3409	0.00
2	A_g	3332	3277	0.00
3	A_g	1694	1666	0.00
4	A_g	1158	1139	0.00
5	A_g	518	509	0.00
6	A_g	168	165	0.00
7	A_u	3492	3434	0.73
8	A_u	1710	1681	26.82
9	A_u	278	273	115.99
10	A_u	115	113	34.12
11	B_g	3491	3433	0.00
12	B_g	1697	1669	0.00
13	B_g	150	148	0.00
14	B_u	3466	3409	21.38
15	B_u	3336	3281	50.25
16	B_u	1660	1633	11.93
17	B_u	1128	1109	305.42
18	B_u	111	110	345.38

Atom	x (Å)	y (Å)	z (Å)
H1	0.673	0.741	0.000
N2	0.000	1.521	0.000
N3	0.000	-1.521	0.000
H4	0.239	2.096	0.817
H5	0.239	2.096	-0.817
H6	-0.673	-0.741	0.000
H7	-0.239	-2.096	-0.817
H8	-0.239	-2.096	0.817

	H1	N2	N3	H4	H5	H6	H7	H8
H1		1.0300	2.3601	1.6406	1.6406	2.0022	3.0903	3.0903
N2	1.0300		3.0420	1.0272	1.0272	2.3601	3.7160	3.7160
N3	2.3601	3.0420		3.7160	3.7160	1.0300	1.0272	1.0272
H4	1.6406	1.0272	3.7160		1.6335	3.0903	4.5248	4.2197
H5	1.6406	1.0272	3.7160	1.6335		3.0903	4.2197	4.5248
H6	2.0022	2.3601	1.0300	3.0903	3.0903		1.6406	1.6406
H7	3.0903	3.7160	1.0272	4.5248	4.2197	1.6406		1.6335
H8	3.0903	3.7160	1.0272	4.2197	4.5248	1.6406	1.6335

Number	Element	Mulliken
1	H	0.325
2	N	-0.916
3	N	-0.916
4	H	0.295
5	H	0.295
6	H	0.325
7	H	0.295
8	H	0.295

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

using model chemistry: PBEPBEultrafine_cp/6-31G*

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>	62.794
(<r²>)^1/2	7.924

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

using model chemistry: PBEPBEultrafine_cp/6-31G*

States and conformations

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