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	hartrees
Energy at 0K	-376.957725
Energy at 298.15K	-376.958208
Nuclear repulsion energy	36.845636

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3295	3236	15.91
2	Σ	1339	1315	1.45
3	Π	743	730	87.05
3	Π	743	730	87.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.002
H2	0.000	0.000	-2.085
P3	0.000	0.000	0.540

	C1	H2	P3
C1		1.0832	1.5418
H2	1.0832		2.6250
P3	1.5418	2.6250

Number	Element	Mulliken
1	C	-0.414
2	H	0.257
3	P	0.157

All results from a given calculation for HCP (Phosphaethyne)

using model chemistry: LSDA/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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<r²>	0.000
(<r²>)^1/2	0.000