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	hartrees
Energy at 0K	-679.368734
Energy at 298.15K	-679.372711
HF Energy	-678.294132
Nuclear repulsion energy	276.698195

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3238	3059	14.36
2	A'	1405	1328	77.73
3	A'	1177	1112	250.19
4	A'	940	888	181.28
5	A'	855	808	66.86
6	A'	517	489	52.09
7	A'	490	463	78.52
8	A'	387	366	54.73
9	A'	275	260	1.01
10	A"	3347	3162	6.84
11	A"	1034	976	217.23
12	A"	821	776	1.49
13	A"	462	436	1.40
14	A"	370	350	16.03
15	A"	194	183	0.46

Atom	x (Å)	y (Å)	z (Å)
P1	-0.023	0.114	0.000
C2	-0.486	1.658	0.000
F3	1.448	-0.389	0.000
F4	-0.486	-0.696	1.221
F5	-0.486	-0.696	-1.221
H6	-0.510	2.190	-0.934
H7	-0.510	2.190	0.934

	P1	C2	F3	F4	F5	H6	H7
P1		1.6115	1.5545	1.5363	1.5363	2.3277	2.3277
C2	1.6115		2.8151	2.6516	2.6516	1.0752	1.0752
F3	1.5545	2.8151		2.3070	2.3070	3.3692	3.3692
F4	1.5363	2.6516	2.3070		2.4415	3.6017	2.9004
F5	1.5363	2.6516	2.3070	2.4415		2.9004	3.6017
H6	2.3277	1.0752	3.3692	3.6017	2.9004		1.8678
H7	2.3277	1.0752	3.3692	2.9004	3.6017	1.8678

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.722	P1	C2	H7	118.722
C2	P1	F3	125.530	C2	P1	F4	114.762
C2	P1	F5	114.762	F3	P1	F4	96.560
F3	P1	F5	96.560	F4	P1	F5	105.240
H6	C2	H7	120.597

All results from a given calculation for PF₃CH₂ (phosphorane, trifluoromethylene-)

using model chemistry: MP3/cc-pVTZ

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 PF3CH2 (phosphorane, trifluoromethylene-)

using model chemistry: MP3/cc-pVTZ

States and conformations

All results from a given calculation for PF₃CH₂ (phosphorane, trifluoromethylene-)