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	hartrees
Energy at 0K	-7773.442016
Energy at 298.15K
HF Energy	-7771.459496
Nuclear repulsion energy	832.720557

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	448	448	1.94
2	A₁	232	232	0.33
3	E	659	659	12.49
3	E	659	659	12.49
4	E	164	164	0.09
4	E	164	164	0.09

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.607
Br2	0.000	1.787	-0.040
Br3	1.548	-0.894	-0.040
Br4	-1.548	-0.894	-0.040

	N1	Br2	Br3	Br4
N1		1.9012	1.9012	1.9012
Br2	1.9012		3.0960	3.0960
Br3	1.9012	3.0960		3.0960
Br4	1.9012	3.0960	3.0960

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	N1	Br3	109.024		Br2	N1	Br4	109.024
Br3	N1	Br4	109.024

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

using model chemistry: CCSD=FULL/6-311+G(3df,2p)

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: CCSD=FULL/6-311+G(3df,2p)

States and conformations

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