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	hartrees
Energy at 0K	-56.180539
Energy at 298.15K	-56.176421
Nuclear repulsion energy	12.115237

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.058
H2	0.000	0.975	-0.136
H3	0.845	-0.488	-0.136
H4	-0.845	-0.488	-0.136
X5	0.000	0.000	1.058

	N1	H2	H3	H4	X5
N1		0.9944	0.9944	0.9944	1.0000
H2	0.9944		1.6891	1.6891	1.5419
H3	0.9944	1.6891		1.6891	1.5419
H4	0.9944	1.6891	1.6891		1.5419
X5	1.0000	1.5419	1.5419	1.5419

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	N1	H3	116.277	H2	N1	H4	116.277
H2	N1	X5	101.270	H3	N1	H4	116.277
H3	N1	X5	101.270	H4	N1	X5	101.270

Number	Element	Mulliken
1	N	-0.968
2	H	0.323
3	H	0.323
4	H	0.323

All results from a given calculation for ND₃ (Ammonia-d3)

using model chemistry: HF/SDD

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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<r²>	7.297
(<r²>)^1/2	2.701

All results from a given calculation for ND3 (Ammonia-d3)

using model chemistry: HF/SDD

States and conformations

All results from a given calculation for ND₃ (Ammonia-d3)