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	hartrees
Energy at 0K	-173.491461
Energy at 298.15K	-173.490947
HF Energy	-173.300414
Nuclear repulsion energy	53.651334

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3661	3661	98.40
2	Σ	2427	2427	2.43
3	Σ	1032	1032	6.53
4	Π	678	678	12.45
4	Π	678	678	12.45
5	Π	358	358	1.69
5	Π	358	358	1.69

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.117
C2	0.000	0.000	-1.329
F3	0.000	0.000	1.233
H4	0.000	0.000	-2.414

	C1	C2	F3	H4
C1		1.2119	1.3503	2.2965
C2	1.2119		2.5621	1.0847
F3	1.3503	2.5621		3.6468
H4	2.2965	1.0847	3.6468

All results from a given calculation for HCCF (Fluoroacetylene)

using model chemistry: QCISD/STO-3G

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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