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	hartrees
Energy at 0K	-56.537196
Energy at 298.15K	-56.539861
HF Energy	-56.457299
Nuclear repulsion energy	11.968282

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3494	3340	1.98	125.21	0.04	0.08
2	A₁	1078	1031	149.23	4.14	0.07	0.13
3	E	3618	3458	1.17	43.28	0.75	0.86
3	E	3618	3458	1.17	43.28	0.75	0.86
4	E	1690	1615	16.40	4.46	0.75	0.86
4	E	1690	1615	16.40	4.46	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.115
H2	0.000	0.935	-0.269
H3	0.810	-0.468	-0.269
H4	-0.810	-0.468	-0.269

	N1	H2	H3	H4
N1		1.0113	1.0113	1.0113
H2	1.0113		1.6198	1.6198
H3	1.0113	1.6198		1.6198
H4	1.0113	1.6198	1.6198

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	N1	H3	106.423		H2	N1	H4	106.423
H3	N1	H4	106.423

All results from a given calculation for NH₃ (Ammonia)

using model chemistry: B2PLYP=FULL/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 NH3 (Ammonia)

using model chemistry: B2PLYP=FULL/cc-pVTZ

States and conformations

All results from a given calculation for NH₃ (Ammonia)