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	hartrees
Energy at 0K	-176.271500
Energy at 298.15K
HF Energy	-175.721541
Nuclear repulsion energy	55.640703

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3515	3515	89.36
2	Σ	2338	2338	118.24
3	Σ	1094	1094	80.26
4	Π	633	633	48.78
4	Π	633	633	48.78
5	Π	401	401	1.37
5	Π	401	401	1.37

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.094
C2	0.000	0.000	-1.289
F3	0.000	0.000	1.183
H4	0.000	0.000	-2.349

	C1	C2	F3	H4
C1		1.1943	1.2771	2.2544
C2	1.1943		2.4714	1.0602
F3	1.2771	2.4714		3.5316
H4	2.2544	1.0602	3.5316

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: CCD/Def2TZVPP

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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