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	hartrees
Energy at 0K	-679.364805
Energy at 298.15K	-679.368687
HF Energy	-678.292606
Nuclear repulsion energy	275.090036

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3233	3069	17.72
2	A'	1388	1318	74.30
3	A'	1165	1106	227.80
4	A'	912	866	173.28
5	A'	828	786	71.89
6	A'	499	474	41.26
7	A'	474	451	75.11
8	A'	373	354	59.16
9	A'	269	256	0.84
10	A"	3348	3179	10.20
11	A"	1006	955	208.31
12	A"	808	767	0.85
13	A"	451	428	0.81
14	A"	363	345	15.20
15	A"	190	180	0.68

Atom	x (Å)	y (Å)	z (Å)
P1	-0.024	0.115	0.000
C2	-0.490	1.660	0.000
F3	1.459	-0.389	0.000
F4	-0.490	-0.699	1.231
F5	-0.490	-0.699	-1.231
H6	-0.505	2.191	-0.936
H7	-0.505	2.191	0.936

	P1	C2	F3	F4	F5	H6	H7
P1		1.6138	1.5663	1.5470	1.5470	2.3272	2.3272
C2	1.6138		2.8275	2.6606	2.6606	1.0759	1.0759
F3	1.5663	2.8275		2.3254	2.3254	3.3743	3.3743
F4	1.5470	2.6606	2.3254		2.4615	3.6116	2.9047
F5	1.5470	2.6606	2.3254	2.4615		2.9047	3.6116
H6	2.3272	1.0759	3.3743	3.6116	2.9047		1.8714
H7	2.3272	1.0759	3.3743	2.9047	3.6116	1.8714

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.447	P1	C2	H7	118.447
C2	P1	F3	125.524	C2	P1	F4	114.635
C2	P1	F5	114.635	F3	P1	F4	96.644
F3	P1	F5	96.644	F4	P1	F5	105.413
H6	C2	H7	120.859

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

using model chemistry: MP2/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: MP2/cc-pVTZ

States and conformations

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