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	hartrees
Energy at 0K	-175.000259
Energy at 298.15K
HF Energy	-174.690304
Nuclear repulsion energy	54.437127

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3490	3338	57.63
2	Σ	2330	2229	32.16
3	Σ	1063	1016	39.87
4	Π	676	647	57.07
4	Π	676	647	57.07
5	Π	419	401	1.32
5	Π	419	401	1.32

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.109
C2	0.000	0.000	-1.314
F3	0.000	0.000	1.213
H4	0.000	0.000	-2.379

	C1	C2	F3	H4
C1		1.2052	1.3220	2.2695
C2	1.2052		2.5272	1.0644
F3	1.3220	2.5272		3.5916
H4	2.2695	1.0644	3.5916

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: CCD/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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