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	hartrees
Energy at 0K	-680.007392
Energy at 298.15K	-680.011263
HF Energy	-679.663542
Nuclear repulsion energy	272.954184

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3208	3208	16.19
2	A'	1392	1392	78.19
3	A'	1160	1160	226.07
4	A'	872	872	183.68
5	A'	792	792	102.23
6	A'	540	540	90.34
7	A'	468	468	61.71
8	A'	364	364	45.59
9	A'	257	257	1.01
10	A"	3317	3317	8.59
11	A"	978	978	232.94
12	A"	816	816	0.02
13	A"	450	450	0.08
14	A"	364	364	18.59
15	A"	204	204	1.28

Atom	x (Å)	y (Å)	z (Å)
P1	-0.023	0.122	0.000
C2	-0.495	1.662	0.000
F3	1.471	-0.409	0.000
F4	-0.495	-0.696	1.245
F5	-0.495	-0.696	-1.245
H6	-0.518	2.199	-0.935
H7	-0.518	2.199	0.935

	P1	C2	F3	F4	F5	H6	H7
P1		1.6104	1.5857	1.5627	1.5627	2.3306	2.3306
C2	1.6104		2.8558	2.6663	2.6663	1.0786	1.0786
F3	1.5857	2.8558		2.3444	2.3444	3.4110	3.4110
F4	1.5627	2.6663	2.3444		2.4898	3.6238	2.9111
F5	1.5627	2.6663	2.3444	2.4898		2.9111	3.6238
H6	2.3306	1.0786	3.4110	3.6238	2.9111		1.8706
H7	2.3306	1.0786	3.4110	2.9111	3.6238	1.8706

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.824	P1	C2	H7	118.824
C2	P1	F3	126.637	C2	P1	F4	114.334
C2	P1	F5	114.334	F3	P1	F4	96.256
F3	P1	F5	96.256	F4	P1	F5	105.623
H6	C2	H7	120.262

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

using model chemistry: B2PLYP=FULL/6-311G**

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: B2PLYP=FULL/6-311G**

States and conformations

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