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	hartrees
Energy at 0K	-2652.076050
Energy at 298.15K
HF Energy	-2651.812135
Nuclear repulsion energy	121.460670

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2063	1970	1.21
2	Σ	552	527	0.37
3	Π	427	408	0.78
3	Π	427	408	0.78

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.173
N2	0.000	0.000	-2.365
Br3	0.000	0.000	0.674

	C1	N2	Br3
C1		1.1918	1.8474
N2	1.1918		3.0392
Br3	1.8474	3.0392

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

using model chemistry: MP2=FULL/3-21G

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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