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	hartrees
Energy at 0K	-2662.170729
Energy at 298.15K
HF Energy	-2662.170729
Nuclear repulsion energy	126.202587

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	2586	2334	31.87	62.67	0.30	0.46
2	Σ	629	568	0.00	4.10	0.18	0.31
3	Π	442	399	4.90	3.18	0.75	0.86
3	Π	442	399	4.90	3.18	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.137
N2	0.000	0.000	-2.271
Br3	0.000	0.000	0.649

	C1	N2	Br3
C1		1.1344	1.7861
N2	1.1344		2.9205
Br3	1.7861	2.9205

Number	Element	Mulliken
1	C	0.324
2	N	-0.383
3	Br	0.060

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

using model chemistry: HF/6-31G**

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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<r²>	77.828
(<r²>)^1/2	8.822