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	hartrees
Energy at 0K	-2849.510988
Energy at 298.15K	-2849.516376
HF Energy	-2848.674217
Nuclear repulsion energy	333.009636

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1886	1785	345.70
2	A'	1403	1328	294.30
3	A'	871	825	285.03
4	A'	786	744	3.67
5	A'	661	625	36.38
6	A'	412	390	0.15
7	A'	233	221	0.27
8	A"	762	721	16.47
9	A"	109	103	0.25

Atom	x (Å)	y (Å)
Br1	-1.139	-0.553
O2	0.000	0.918
N3	1.397	0.576
O4	2.056	1.580
O5	1.707	-0.583

	Br1	O2	N3	O4	O5
Br1		1.8605	2.7760	3.8417	2.8460
O2	1.8605		1.4376	2.1597	2.2724
N3	2.7760	1.4376		1.2008	1.1999
O4	3.8417	2.1597	1.2008		2.1909
O5	2.8460	2.2724	1.1999	2.1909

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br1	O2	N3	114.025		O2	N3	O4	109.555
O2	N3	O5	118.709		O4	N3	O5	131.736

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

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 BrONO2 (Bromine nitrate)

using model chemistry: CCD/6-31G*

States and conformations

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