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	hartrees
Energy at 0K	-380.029177
Energy at 298.15K	-380.029643
Nuclear repulsion energy	37.018721

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3361	3222	9.32
2	Σ	1363	1307	0.51
3	Π	719	689	84.73
3	Π	719	689	84.73

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.998
H2	0.000	0.000	-2.072
P3	0.000	0.000	0.537

	C1	H2	P3
C1		1.0740	1.5353
H2	1.0740		2.6093
P3	1.5353	2.6093

Number	Element	Mulliken
1	C	-0.514
2	H	0.243
3	P	0.270

All results from a given calculation for HCP (Phosphaethyne)

using model chemistry: B1B95/6-311G*

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>	26.105
(<r²>)^1/2	5.109