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	hartrees
Energy at 0K	-678.921894
Energy at 298.15K	-678.925775
HF Energy	-678.100896
Nuclear repulsion energy	272.206472

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3216	3216
2	A'	1429	1429
3	A'	1179	1179
4	A'	920	920
5	A'	819	819
6	A'	554	554
7	A'	468	468
8	A'	357	357
9	A'	255	255
10	A"	3322	3322
11	A"	1027	1027
12	A"	841	841
13	A"	459	459
14	A"	365	365
15	A"	204	204

Atom	x (Å)	y (Å)	z (Å)
P1	-0.023	0.124	0.000
C2	-0.493	1.670	0.000
F3	1.468	-0.424	0.000
F4	-0.493	-0.694	1.251
F5	-0.493	-0.694	-1.251
H6	-0.519	2.213	-0.938
H7	-0.519	2.213	0.938

	P1	C2	F3	F4	F5	H6	H7
P1		1.6159	1.5886	1.5676	1.5676	2.3425	2.3425
C2	1.6159		2.8696	2.6752	2.6752	1.0839	1.0839
F3	1.5886	2.8696		2.3423	2.3423	3.4324	3.4324
F4	1.5676	2.6752	2.3423		2.5022	3.6393	2.9240
F5	1.5676	2.6752	2.3423	2.5022		2.9240	3.6393
H6	2.3425	1.0839	3.4324	3.6393	2.9240		1.8762
H7	2.3425	1.0839	3.4324	2.9240	3.6393	1.8762

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	119.049	P1	C2	H7	119.049
C2	P1	F3	127.137	C2	P1	F4	114.343
C2	P1	F5	114.343	F3	P1	F4	95.822
F3	P1	F5	95.822	F4	P1	F5	105.904
H6	C2	H7	119.872

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

using model chemistry: QCISD(T)=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: QCISD(T)=FULL/6-31G*

States and conformations

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