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	hartrees
Energy at 0K	-514.156116
Energy at 298.15K
HF Energy	-513.875791
Nuclear repulsion energy	50.444324

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3393	3245	3.66
2	A₁	1736	1660	2651.00
3	A₁	1197	1145	210.65
4	A₁	258	247	84.56
5	E	3528	3374	7.52
5	E	3528	3374	7.52
6	E	1771	1694	24.80
6	E	1771	1694	24.80
7	E	1097	1049	98.60
7	E	1097	1049	98.60
8	E	336	321	17.26
8	E	336	321	17.26

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.824
Cl2	0.000	0.000	1.145
H3	0.000	0.970	-2.155
H4	0.840	-0.485	-2.155
H5	-0.840	-0.485	-2.155
H6	0.000	0.000	-0.231

	N1	Cl2	H3	H4	H5	H6
N1		2.9690	1.0248	1.0248	1.0248	1.5930
Cl2	2.9690		3.4400	3.4400	3.4400	1.3761
H3	1.0248	3.4400		1.6795	1.6795	2.1549
H4	1.0248	3.4400	1.6795		1.6795	2.1549
H5	1.0248	3.4400	1.6795	1.6795		2.1549
H6	1.5930	1.3761	2.1549	2.1549	2.1549

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	110.061
H3	N1	H5	110.061	H3	N1	H6	108.875
H4	N1	H5	110.061	H4	N1	H6	108.875
H5	N1	H6	108.875

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

using model chemistry: CCD/3-21G*

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/3-21G*

States and conformations

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