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	hartrees
Energy at 0K	-675.263123
Energy at 298.15K	-675.267252
HF Energy	-674.719662
Nuclear repulsion energy	273.673478

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3240	3083	14.71
2	A'	1499	1426	77.23
3	A'	1251	1190	230.97
4	A'	1005	956	200.38
5	A'	879	836	47.96
6	A'	705	671	175.21
7	A'	490	466	62.47
8	A'	408	388	35.46
9	A'	288	274	0.22
10	A"	3334	3171	3.80
11	A"	1100	1047	209.55
12	A"	884	841	4.97
13	A"	464	441	1.88
14	A"	385	366	18.07
15	A"	168	160	0.28

Atom	x (Å)	y (Å)	z (Å)
P1	-0.027	0.120	0.000
C2	-0.486	1.656	0.000
F3	1.470	-0.372	0.000
F4	-0.486	-0.711	1.238
F5	-0.486	-0.711	-1.238
H6	-0.588	2.204	-0.927
H7	-0.588	2.204	0.927

	P1	C2	F3	F4	F5	H6	H7
P1		1.6028	1.5761	1.5603	1.5603	2.3482	2.3482
C2	1.6028		2.8179	2.6714	2.6714	1.0812	1.0812
F3	1.5761	2.8179		2.3394	2.3394	3.4250	3.4250
F4	1.5603	2.6714	2.3394		2.4759	3.6322	2.9334
F5	1.5603	2.6714	2.3394	2.4759		2.9334	3.6322
H6	2.3482	1.0812	3.4250	3.6322	2.9334		1.8532
H7	2.3482	1.0812	3.4250	2.9334	3.6322	1.8532

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	120.824	P1	C2	H7	120.824
C2	P1	F3	124.855	C2	P1	F4	115.245
C2	P1	F5	115.245	F3	P1	F4	96.468
F3	P1	F5	96.468	F4	P1	F5	105.009
H6	C2	H7	117.965

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

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