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	hartrees
Energy at 0K	-3599.183742
Energy at 298.15K	-3599.182031
HF Energy	-3599.183742
Nuclear repulsion energy	522.109356

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	382	382	22.24
2	A₁	165	165	7.78
3	E	370	370	72.16
3	E	370	370	72.12
4	E	127	127	2.06
4	E	127	127	2.07

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.648
Cl2	0.000	2.015	-0.419
Cl3	1.745	-1.007	-0.419
Cl4	-1.745	-1.007	-0.419

	As1	Cl2	Cl3	Cl4
As1		2.2799	2.2799	2.2799
Cl2	2.2799		3.4895	3.4895
Cl3	2.2799	3.4895		3.4895
Cl4	2.2799	3.4895	3.4895

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	As1	Cl3	99.860		Cl2	As1	Cl4	99.860
Cl3	As1	Cl4	99.860

All results from a given calculation for AsCl₃ (Arsenous trichloride)

using model chemistry: wB97X-D/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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Number	Element	Mulliken
1	As	0.813
2	Cl	-0.271
3	Cl	-0.271
4	Cl	-0.271

	x	y	z	Total
	0.000	0.000	3.066	3.066
CHELPG
AIM
ESP

	x	y	z
x	9.826	0.000	0.000
y	0.000	9.815	0.004
z	0.000	0.004	5.188

<r²>	267.078
(<r²>)^1/2	16.343

All results from a given calculation for AsCl3 (Arsenous trichloride)

using model chemistry: wB97X-D/3-21G

States and conformations

All results from a given calculation for AsCl₃ (Arsenous trichloride)