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	hartrees
Energy at 0K	-2662.942040
Energy at 298.15K
HF Energy	-2662.360804
Nuclear repulsion energy	127.142515

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2426	2426	18.47
2	Σ	655	655	0.28
3	Π	428	428	2.76
3	Π	428	428	2.76

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.114
N2	0.000	0.000	-2.264
Br3	0.000	0.000	0.644

	C1	N2	Br3
C1		1.1500	1.7576
N2	1.1500		2.9076
Br3	1.7576	2.9076

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

using model chemistry: MP3=FULL/6-31G(2df,p)

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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