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	hartrees
Energy at 0K	-678.899584
Energy at 298.15K	-678.903443
HF Energy	-678.099821
Nuclear repulsion energy	271.371123

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3222	3076
2	A'	1430	1365
3	A'	1173	1120
4	A'	904	863
5	A'	806	770
6	A'	555	530
7	A'	462	441
8	A'	354	338
9	A'	251	240
10	A"	3328	3177
11	A"	1015	969
12	A"	841	803
13	A"	459	438
14	A"	363	346
15	A"	208	198

Atom	x (Å)	y (Å)	z (Å)
P1	-0.022	0.125	0.000
C2	-0.496	1.673	0.000
F3	1.473	-0.431	0.000
F4	-0.496	-0.693	1.257
F5	-0.496	-0.693	-1.257
H6	-0.510	2.217	-0.938
H7	-0.510	2.217	0.938

	P1	C2	F3	F4	F5	H6	H7
P1		1.6189	1.5949	1.5729	1.5729	2.3436	2.3436
C2	1.6189		2.8816	2.6794	2.6794	1.0841	1.0841
F3	1.5949	2.8816		2.3505	2.3505	3.4381	3.4381
F4	1.5729	2.6794	2.3505		2.5135	3.6449	2.9278
F5	1.5729	2.6794	2.3505	2.5135		2.9278	3.6449
H6	2.3436	1.0841	3.4381	3.6449	2.9278		1.8752
H7	2.3436	1.0841	3.4381	2.9278	3.6449	1.8752

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.907	P1	C2	H7	118.907
C2	P1	F3	127.438	C2	P1	F4	114.158
C2	P1	F5	114.158	F3	P1	F4	95.800
F3	P1	F5	95.800	F4	P1	F5	106.066
H6	C2	H7	119.746

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

using model chemistry: MP4/6-31G*

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: MP4/6-31G*

States and conformations

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