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	hartrees
Energy at 0K	-711.671654
Energy at 298.15K
HF Energy	-710.178208
Nuclear repulsion energy	507.912105

Atom	x (Å)	y (Å)	z (Å)
C1	-0.024	1.421	0.000
C2	-0.504	0.173	0.000
C3	0.280	-1.098	0.000
F4	-0.812	2.487	0.000
F5	1.261	1.741	0.000
F6	-1.841	-0.022	0.000
F7	1.605	-0.863	0.000
F8	-0.024	-1.837	1.088
F9	-0.024	-1.837	-1.088

	C1	C2	C3	F4	F5	F6	F7	F8	F9
C1		1.3375	2.5376	1.3250	1.3239	2.3208	2.8056	3.4355	3.4355
C2	1.3375		1.4930	2.3339	2.3607	1.3517	2.3496	2.3356	2.3356
C3	2.5376	1.4930		3.7470	3.0040	2.3784	1.3462	1.3499	1.3499
F4	1.3250	2.3339	3.7470		2.2028	2.7112	4.1305	4.5276	4.5276
F5	1.3239	2.3607	3.0040	2.2028		3.5681	2.6268	3.9547	3.9547
F6	2.3208	1.3517	2.3784	2.7112	3.5681		3.5476	2.7897	2.7897
F7	2.8056	2.3496	1.3462	4.1305	2.6268	3.5476		2.1879	2.1879
F8	3.4355	2.3356	1.3499	4.5276	3.9547	2.7897	2.1879		2.1760
F9	3.4355	2.3356	1.3499	4.5276	3.9547	2.7897	2.1879	2.1760

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	127.326	C1	C2	F6	119.314
C2	C1	F4	122.468	C2	C1	F5	125.007
C2	C3	F7	111.587	C2	C3	F8	110.378
C2	C3	F9	110.378	C3	C2	F6	113.360
F4	C1	F5	112.525	F7	C3	F8	108.484
F7	C3	F9	108.484	F8	C3	F8	0.000

All results from a given calculation for C₃F₆ (hexafluoropropene)

using model chemistry: MP4=FULL/6-31G*

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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All results from a given calculation for C3F6 (hexafluoropropene)

using model chemistry: MP4=FULL/6-31G*

States and conformations

All results from a given calculation for C₃F₆ (hexafluoropropene)