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	hartrees
Energy at 0K	-678.859814
Energy at 298.15K	-678.863714
HF Energy	-678.100655
Nuclear repulsion energy	271.973081

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3268	3082	19.76
2	A'	1444	1362	69.54
3	A'	1188	1121	203.92
4	A'	915	863	180.56
5	A'	821	774	74.52
6	A'	558	526	101.35
7	A'	467	440	55.34
8	A'	370	349	43.05
9	A'	258	243	0.40
10	A"	3378	3186	8.97
11	A"	1022	964	222.65
12	A"	842	794	0.40
13	A"	458	432	0.03
14	A"	367	346	17.23
15	A"	203	192	0.84

Atom	x (Å)	y (Å)	z (Å)
P1	-0.024	0.124	0.000
C2	-0.493	1.667	0.000
F3	1.472	-0.416	0.000
F4	-0.493	-0.696	1.254
F5	-0.493	-0.696	-1.254
H6	-0.523	2.207	-0.935
H7	-0.523	2.207	0.935

	P1	C2	F3	F4	F5	H6	H7
P1		1.6131	1.5909	1.5702	1.5702	2.3371	2.3371
C2	1.6131		2.8644	2.6754	2.6754	1.0803	1.0803
F3	1.5909	2.8644		2.3484	2.3484	3.4257	3.4257
F4	1.5702	2.6754	2.3484		2.5082	3.6361	2.9204
F5	1.5702	2.6754	2.3484	2.5082		2.9204	3.6361
H6	2.3371	1.0803	3.4257	3.6361	2.9204		1.8709
H7	2.3371	1.0803	3.4257	2.9204	3.6361	1.8709

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	119.061	P1	C2	H7	119.061
C2	P1	F3	126.768	C2	P1	F4	114.370
C2	P1	F5	114.370	F3	P1	F4	95.960
F3	P1	F5	95.960	F4	P1	F5	106.015
H6	C2	H7	119.968

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

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

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