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	hartrees
Energy at 0K	-176.102040
Energy at 298.15K
HF Energy	-175.653878
Nuclear repulsion energy	54.950727

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3512	3360	87.03
2	Σ	2327	2226	93.62
3	Σ	1074	1027	80.35
4	Π	623	596	41.95
4	Π	623	596	41.95
5	Π	404	386	2.69
5	Π	404	386	2.69

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.093
C2	0.000	0.000	-1.306
F3	0.000	0.000	1.197
H4	0.000	0.000	-2.380

	C1	C2	F3	H4
C1		1.2125	1.2903	2.2870
C2	1.2125		2.5028	1.0745
F3	1.2903	2.5028		3.5773
H4	2.2870	1.0745	3.5773

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: CCD/cc-pVDZ

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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