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	hartrees
Energy at 0K	-679.387067
Energy at 298.15K	-679.390965
HF Energy	-678.321323
Nuclear repulsion energy	276.234005

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3234	3077	17.96
2	A'	1391	1324	81.93
3	A'	1167	1111	236.17
4	A'	921	877	178.17
5	A'	838	797	69.55
6	A'	502	478	42.17
7	A'	480	456	77.88
8	A'	384	366	54.51
9	A'	275	262	0.60
10	A"	3349	3186	10.45
11	A"	1013	964	217.12
12	A"	798	759	1.90
13	A"	453	431	1.25
14	A"	366	349	13.80
15	A"	187	178	0.57

Atom	x (Å)	y (Å)	z (Å)
P1	-0.024	0.110	0.000
C2	-0.486	1.648	0.000
F3	1.457	-0.370	0.000
F4	-0.486	-0.698	1.226
F5	-0.486	-0.698	-1.226
H6	-0.542	2.180	-0.933
H7	-0.542	2.180	0.933

	P1	C2	F3	F4	F5	H6	H7
P1		1.6060	1.5572	1.5397	1.5397	2.3291	2.3291
C2	1.6060		2.8014	2.6476	2.6476	1.0757	1.0757
F3	1.5572	2.8014		2.3213	2.3213	3.3719	3.3719
F4	1.5397	2.6476	2.3213		2.4529	3.5990	2.8938
F5	1.5397	2.6476	2.3213	2.4529		2.8938	3.5990
H6	2.3291	1.0757	3.3719	3.5990	2.8938		1.8666
H7	2.3291	1.0757	3.3719	2.8938	3.5990	1.8666

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	119.250	P1	C2	H7	119.250
C2	P1	F3	124.652	C2	P1	F4	114.618
C2	P1	F5	114.618	F3	P1	F4	97.100
F3	P1	F5	97.100	F4	P1	F5	105.600
H6	C2	H7	120.364

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

using model chemistry: MP2/Def2TZVPP

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/Def2TZVPP

States and conformations

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