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	hartrees
Energy at 0K	-516.593589
Energy at 298.15K
HF Energy	-516.256875
Nuclear repulsion energy	48.464769

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3486	3299	2.02
2	A₁	2543	2407	1106.76
3	A₁	1231	1165	140.92
4	A₁	194	184	13.82
5	E	3623	3429	6.06
5	E	3623	3429	6.06
6	E	1743	1650	26.44
6	E	1743	1650	26.44
7	E	735	695	101.40
7	E	735	695	101.40
8	E	245	232	23.85
8	E	245	232	23.85

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.956
Cl2	0.000	0.000	1.224
H3	0.000	0.945	-2.340
H4	0.818	-0.472	-2.340
H5	-0.818	-0.472	-2.340
H6	0.000	0.000	-0.092

	N1	Cl2	H3	H4	H5	H6
N1		3.1801	1.0195	1.0195	1.0195	1.8639
Cl2	3.1801		3.6870	3.6870	3.6870	1.3163
H3	1.0195	3.6870		1.6359	1.6359	2.4381
H4	1.0195	3.6870	1.6359		1.6359	2.4381
H5	1.0195	3.6870	1.6359	1.6359		2.4381
H6	1.8639	1.3163	2.4381	2.4381	2.4381

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	106.702
H3	N1	H5	106.702	H3	N1	H6	112.116
H4	N1	H5	106.702	H4	N1	H6	112.116
H5	N1	H6	112.116

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

using model chemistry: CCD/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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All results from a given calculation for NH4Cl (Ammonium chloride)

using model chemistry: CCD/6-31G*

States and conformations

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