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	hartrees
Energy at 0K	-2847.784814
Energy at 298.15K	-2847.790121
HF Energy	-2847.784814
Nuclear repulsion energy	334.716137

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1850	1816	219.37
2	A'	1362	1337	237.53
3	A'	809	793	161.57
4	A'	734	721	0.44
5	A'	561	550	39.84
6	A'	405	398	0.66
7	A'	208	204	0.10
8	A"	723	709	10.51
9	A"	148	146	0.24

Atom	x (Å)	y (Å)
Br1	-1.140	-0.521
O2	0.000	0.918
N3	1.410	0.532
O4	2.078	1.531
O5	1.675	-0.636

	Br1	O2	N3	O4	O5
Br1		1.8350	2.7586	3.8155	2.8166
O2	1.8350		1.4619	2.1661	2.2839
N3	2.7586	1.4619		1.2010	1.1972
O4	3.8155	2.1661	1.2010		2.2032
O5	2.8166	2.2839	1.1972	2.2032

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br1	O2	N3	113.106		O2	N3	O4	108.471
O2	N3	O5	118.051		O4	N3	O5	133.478

All results from a given calculation for BrONO₂ (Bromine nitrate)

using model chemistry: LSDA/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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Number	Element	Mulliken
1	Br	0.212
2	O	-0.315
3	N	0.657
4	O	-0.272
5	O	-0.281

	x	y	z	Total
	-1.184	-0.895	0.000	1.484
CHELPG
AIM
ESP

	x	y	z
x	7.962	1.924	0.000
y	1.924	5.918	0.000
z	0.000	0.000	2.896

<r²>	180.892
(<r²>)^1/2	13.450

All results from a given calculation for BrONO2 (Bromine nitrate)

using model chemistry: LSDA/6-31G**

States and conformations

All results from a given calculation for BrONO₂ (Bromine nitrate)