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	hartrees
Energy at 0K	-176.416058
Energy at 298.15K
HF Energy	-176.416058
Nuclear repulsion energy	55.770131

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	3513	3374	101.09	21.24	0.26	0.41
2	Σ	2353	2260	129.91	40.41	0.19	0.32
3	Σ	1099	1055	86.80	8.03	0.23	0.37
4	Π	630	605	52.86	1.23	0.75	0.86
4	Π	630	605	52.86	1.23	0.75	0.86
5	Π	441	424	1.87	12.19	0.75	0.86
5	Π	441	424	1.87	12.19	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.093
C2	0.000	0.000	-1.286
F3	0.000	0.000	1.180
H4	0.000	0.000	-2.348

	C1	C2	F3	H4
C1		1.1929	1.2722	2.2549
C2	1.1929		2.4652	1.0620
F3	1.2722	2.4652		3.5272
H4	2.2549	1.0620	3.5272

Number	Element	Mulliken
1	C	0.123
2	C	-0.132
3	F	-0.128
4	H	0.137

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: HSEh1PBE/6-311G**

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>	37.669
(<r²>)^1/2	6.138