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	hartrees
Energy at 0K	-2665.196373
Energy at 298.15K
HF Energy	-2664.688172
Nuclear repulsion energy	125.537238

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2377	2377	18.35
2	Σ	610	610	0.22
3	Π	368	368	2.41
3	Π	368	368	2.41

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.137
N2	0.000	0.000	-2.287
Br3	0.000	0.000	0.652

	C1	N2	Br3
C1		1.1495	1.7897
N2	1.1495		2.9392
Br3	1.7897	2.9392

All results from a given calculation for BrCN (Cyanogen bromide)

using model chemistry: MP3/6-311+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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