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	hartrees
Energy at 0K	-176.551533
Energy at 298.15K
HF Energy	-176.551533
Nuclear repulsion energy	55.208845

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	3500	3375	101.19	23.99	0.24	0.39
2	Σ	2320	2237	130.34	65.48	0.07	0.13
3	Σ	1077	1038	86.03	9.33	0.23	0.37
4	Π	608	586	61.47	2.91	0.75	0.86
4	Π	608	586	61.47	2.91	0.75	0.86
5	Π	403	389	1.85	16.53	0.75	0.86
5	Π	403	389	1.85	16.53	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.096
C2	0.000	0.000	-1.299
F3	0.000	0.000	1.193
H4	0.000	0.000	-2.363

	C1	C2	F3	H4
C1		1.2024	1.2888	2.2671
C2	1.2024		2.4912	1.0647
F3	1.2888	2.4912		3.5559
H4	2.2671	1.0647	3.5559

Number	Element	Mulliken
1	C	-0.065
2	C	0.174
3	F	-0.309
4	H	0.200

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: B3LYP/6-31+G**

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>	38.457
(<r²>)^1/2	6.201