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	hartrees
Energy at 0K	-378.017725
Energy at 298.15K	-378.018172
HF Energy	-378.017725
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3316	3260	8.98
2	Σ	1230	1209	0.89
3	Π	707	695	104.42
3	Π	707	695	104.42

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.031
H2	0.000	0.000	-2.108
P3	0.000	0.000	0.553

	C1	H2	P3
C1		1.0769	1.5842
H2	1.0769		2.6611
P3	1.5842	2.6611

Number	Element	Mulliken
1	C	-0.661
2	H	0.244
3	P	0.417

All results from a given calculation for HCP (Phosphaethyne)

using model chemistry: B97D3/3-21G

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>	26.907
(<r²>)^1/2	5.187