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	hartrees
Energy at 0K	-516.893792
Energy at 298.15K
HF Energy	-516.335577
Nuclear repulsion energy	49.303779

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.909
Cl2	0.000	0.000	1.196
H3	0.000	0.941	-2.281
H4	0.815	-0.471	-2.281
H5	-0.815	-0.471	-2.281
H6	0.000	0.000	-0.120

	N1	Cl2	H3	H4	H5	H6
N1		3.1052	1.0123	1.0123	1.0123	1.7894
Cl2	3.1052		3.6025	3.6025	3.6025	1.3157
H3	1.0123	3.6025		1.6305	1.6305	2.3577
H4	1.0123	3.6025	1.6305		1.6305	2.3577
H5	1.0123	3.6025	1.6305	1.6305		2.3577
H6	1.7894	1.3157	2.3577	2.3577	2.3577

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	H6	Cl2	180.000	H3	N1	H4	107.293
H3	N1	H5	107.293	H3	N1	H6	111.570
H4	N1	H5	107.293	H4	N1	H6	111.570
H5	N1	H6	111.570

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

using model chemistry: QCISD(T)=FULL/daug-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: QCISD(T)=FULL/daug-cc-pVTZ

States and conformations

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