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	hartrees
Energy at 0K	-678.903476
Energy at 298.15K	-678.907398
HF Energy	-678.105656
Nuclear repulsion energy	272.566529

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3301	3085	18.65
2	A'	1443	1348	67.31
3	A'	1193	1115	206.42
4	A'	925	865	180.30
5	A'	827	773	71.00
6	A'	552	515	91.61
7	A'	469	438	56.25
8	A'	372	348	43.80
9	A'	261	244	0.42
10	A"	3419	3194	7.73
11	A"	1028	961	219.34
12	A"	833	778	1.27
13	A"	458	428	0.01
14	A"	367	343	17.74
15	A"	202	189	0.72

Atom	x (Å)	y (Å)	z (Å)
P1	-0.024	0.123	0.000
C2	-0.493	1.663	0.000
F3	1.471	-0.409	0.000
F4	-0.493	-0.697	1.250
F5	-0.493	-0.697	-1.250
H6	-0.519	2.198	-0.932
H7	-0.519	2.198	0.932

	P1	C2	F3	F4	F5	H6	H7
P1		1.6100	1.5871	1.5670	1.5670	2.3274	2.3274
C2	1.6100		2.8554	2.6707	2.6707	1.0745	1.0745
F3	1.5871	2.8554		2.3461	2.3461	3.4093	3.4093
F4	1.5670	2.6707	2.3461		2.5010	3.6249	2.9118
F5	1.5670	2.6707	2.3461	2.5010		2.9118	3.6249
H6	2.3274	1.0745	3.4093	3.6249	2.9118		1.8637
H7	2.3274	1.0745	3.4093	2.9118	3.6249	1.8637

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.861	P1	C2	H7	118.861
C2	P1	F3	126.529	C2	P1	F4	114.409
C2	P1	F5	114.409	F3	P1	F4	96.113
F3	P1	F5	96.113	F4	P1	F5	105.882
H6	C2	H7	120.280

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

using model chemistry: MP2=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 PF3CH2 (phosphorane, trifluoromethylene-)

using model chemistry: MP2=FULL/6-31G**

States and conformations

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