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	hartrees
Energy at 0K	-7772.020847
Energy at 298.15K	-7772.030112
HF Energy	-7771.425099
Nuclear repulsion energy	815.185839

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	436	418	0.52
2	A₁	213	204	0.41
3	E	587	562	28.39
3	E	587	562	28.40
4	E	153	147	0.30
4	E	153	147	0.30

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.627
Br2	0.000	1.825	-0.042
Br3	1.581	-0.913	-0.042
Br4	-1.581	-0.913	-0.042

	N1	Br2	Br3	Br4
N1		1.9440	1.9440	1.9440
Br2	1.9440		3.1616	3.1616
Br3	1.9440	3.1616		3.1616
Br4	1.9440	3.1616	3.1616

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	N1	Br3	108.813		Br2	N1	Br4	108.813
Br3	N1	Br4	108.813

All results from a given calculation for NBr₃ (Nitrogen Tribromide)

using model chemistry: QCISD/6-311G*

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 NBr3 (Nitrogen Tribromide)

using model chemistry: QCISD/6-311G*

States and conformations

All results from a given calculation for NBr₃ (Nitrogen Tribromide)