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	hartrees
Energy at 0K	-176.465848
Energy at 298.15K
HF Energy	-176.294137
Nuclear repulsion energy	55.528339

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	3520	3520	93.88	24.01	0.26	0.41
2	Σ	2303	2303	118.20	33.79	0.19	0.32
3	Σ	1076	1076	79.68	7.87	0.23	0.38
4	Π	616	616	48.73	0.76	0.75	0.86
4	Π	616	616	48.73	0.76	0.75	0.86
5	Π	419	419	2.62	11.73	0.75	0.86
5	Π	419	419	2.62	11.73	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.094
C2	0.000	0.000	-1.292
F3	0.000	0.000	1.185
H4	0.000	0.000	-2.352

	C1	C2	F3	H4
C1		1.1984	1.2787	2.2583
C2	1.1984		2.4771	1.0599
F3	1.2787	2.4771		3.5370
H4	2.2583	1.0599	3.5370

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: B2PLYP=FULL/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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