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	hartrees
Energy at 0K	-516.817674
Energy at 298.15K
HF Energy	-516.335964
Nuclear repulsion energy	48.781282

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3507	3356	0.00
2	A₁	2544	2434	1408.88
3	A₁	1131	1082	138.06
4	A₁	170	163	18.39
5	E	3637	3480	14.90
5	E	3637	3480	14.90
6	E	1686	1613	19.46
6	E	1686	1613	19.46
7	E	713	682	34.25
7	E	713	682	34.25
8	E	211	202	16.91
8	E	211	202	16.91

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.945
Cl2	0.000	0.000	1.216
H3	0.000	0.941	-2.319
H4	0.815	-0.470	-2.319
H5	-0.815	-0.470	-2.319
H6	0.000	0.000	-0.094

	N1	Cl2	H3	H4	H5	H6
N1		3.1612	1.0120	1.0120	1.0120	1.8516
Cl2	3.1612		3.6576	3.6576	3.6576	1.3096
H3	1.0120	3.6576		1.6291	1.6291	2.4157
H4	1.0120	3.6576	1.6291		1.6291	2.4157
H5	1.0120	3.6576	1.6291	1.6291		2.4157
H6	1.8516	1.3096	2.4157	2.4157	2.4157

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	107.203
H3	N1	H5	107.203	H3	N1	H6	111.654
H4	N1	H5	107.203	H4	N1	H6	111.654
H5	N1	H6	111.654

All results from a given calculation for NH₄Cl (Ammonium chloride)

using model chemistry: CCD/aug-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 NH4Cl (Ammonium chloride)

using model chemistry: CCD/aug-cc-pVTZ

States and conformations

All results from a given calculation for NH₄Cl (Ammonium chloride)