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	hartrees
Energy at 0K	-513.798952
Energy at 298.15K	-513.799360
HF Energy	-513.798952
Nuclear repulsion energy	283.716964

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1580	1522	0.00
2	A₁	735	708	0.00
3	A₁	394	380	0.00
4	B₁	154	149	0.00
5	B₂	2135	2057	1022.62
6	B₂	1039	1001	593.23
7	B₂	583	561	19.27
8	E	1228	1183	322.41
8	E	1228	1183	322.41
9	E	649	625	26.93
9	E	649	625	26.93
10	E	556	535	0.43
10	E	556	535	0.43
11	E	95	92	0.00
11	E	95	92	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.000	0.000	1.292
C3	0.000	0.000	-1.292
F4	0.000	1.079	2.057
F5	0.000	-1.079	2.057
F6	1.079	0.000	-2.057
F7	-1.079	0.000	-2.057

	C1	C2	C3	F4	F5	F6	F7
C1		1.2919	1.2919	2.3233	2.3233	2.3233	2.3233
C2	1.2919		2.5839	1.3231	1.3231	3.5189	3.5189
C3	1.2919	2.5839		3.5189	3.5189	1.3231	1.3231
F4	2.3233	1.3231	3.5189		2.1584	4.3888	4.3888
F5	2.3233	1.3231	3.5189	2.1584		4.3888	4.3888
F6	2.3233	3.5189	1.3231	4.3888	4.3888		2.1584
F7	2.3233	3.5189	1.3231	4.3888	4.3888	2.1584

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	125.348	C1	C2	F5	125.348
C1	C3	F6	125.348	C1	C3	F7	125.348
C2	C1	C3	180.000	F4	C2	F5	109.305
F6	C3	F7	109.305

All results from a given calculation for F₂CCCF₂ (tetrafluoroallene)

using model chemistry: B3LYPultrafine/TZVP

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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Number	Element	Mulliken
1	C	-0.223
2	C	0.384
3	C	0.384
4	F	-0.136
5	F	-0.136
6	F	-0.136
7	F	-0.136

<r²>	237.732
(<r²>)^1/2	15.419

All results from a given calculation for F2CCCF2 (tetrafluoroallene)

using model chemistry: B3LYPultrafine/TZVP

States and conformations

All results from a given calculation for F₂CCCF₂ (tetrafluoroallene)