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	hartrees
Energy at 0K	-669.578200
Energy at 298.15K	-669.581486
HF Energy	-669.428234
Nuclear repulsion energy	260.948368

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3376	3001	16.98
2	A'	1688	1501	0.02
3	A'	1111	987	44.42
4	A'	871	774	35.37
5	A'	751	668	101.12
6	A'	591	526	80.82
7	A'	402	357	22.76
8	A'	248	221	29.73
9	A'	187	166	17.76
10	A"	3528	3136	4.18
11	A"	1158	1029	14.71
12	A"	940	835	29.08
13	A"	443	393	15.13
14	A"	299	266	32.17
15	A"	272	241	8.38

Atom	x (Å)	y (Å)	z (Å)
P1	0.057	-0.163	0.000
C2	1.552	-1.013	0.000
F3	-1.608	-0.343	0.000
F4	0.057	0.827	1.302
F5	0.057	0.827	-1.302
H6	1.641	-1.638	-0.904
H7	1.641	-1.638	0.904

	P1	C2	F3	F4	F5	H6	H7
P1		1.7195	1.6746	1.6352	1.6352	2.3457	2.3457
C2	1.7195		3.2297	2.7044	2.7044	1.1022	1.1022
F3	1.6746	3.2297		2.4155	2.4155	3.6125	3.6125
F4	1.6352	2.7044	2.4155		2.6032	3.6672	2.9570
F5	1.6352	2.7044	2.4155	2.6032		2.9570	3.6672
H6	2.3457	1.1022	3.6125	3.6672	2.9570		1.8071
H7	2.3457	1.1022	3.6125	2.9570	3.6672	1.8071

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	110.551	P1	C2	H7	110.551
C2	P1	F3	144.190	C2	P1	F4	107.418
C2	P1	F5	107.418	F3	P1	F4	93.731
F3	P1	F5	93.731	F4	P1	F5	105.498
H6	C2	H7	110.128

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

using model chemistry: MP2=FULL/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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All results from a given calculation for PF3CH2 (phosphorane, trifluoromethylene-)

using model chemistry: MP2=FULL/STO-3G

States and conformations

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