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	hartrees
Energy at 0K	-176.487705
Energy at 298.15K	-176.483467
HF Energy	-176.553740
Nuclear repulsion energy	55.785903

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	3510	3387	93.98	24.97	0.22	0.36
2	Σ	2367	2284	105.11	31.68	0.20	0.33
3	Σ	1108	1069	70.04	8.90	0.21	0.35
4	Π	597	576	47.09	0.00	0.75	0.86
4	Π	597	576	47.09	0.00	0.75	0.86
5	Π	430	415	4.75	8.54	0.75	0.86
5	Π	430	415	4.75	8.54	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.092
C2	0.000	0.000	-1.286
F3	0.000	0.000	1.179
H4	0.000	0.000	-2.346

	C1	C2	F3	H4
C1		1.1937	1.2715	2.2541
C2	1.1937		2.4652	1.0604
F3	1.2715	2.4652		3.5256
H4	2.2541	1.0604	3.5256

Number	Element	Mulliken
1	C	0.306
2	C	-0.536
3	F	0.014
4	H	0.215

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: G4

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>	37.419
(<r²>)^1/2	6.117