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	hartrees
Energy at 0K	-678.876277
Energy at 298.15K	-678.880187
HF Energy	-678.105129
Nuclear repulsion energy	272.098896

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3297	3088	18.23
2	A'	1440	1349	63.88
3	A'	1187	1112	206.79
4	A'	916	858	178.83
5	A'	822	769	73.04
6	A'	551	516	90.24
7	A'	467	437	55.92
8	A'	370	347	43.16
9	A'	258	242	0.45
10	A"	3415	3198	7.46
11	A"	1021	956	218.72
12	A"	833	781	0.64
13	A"	458	429	0.04
14	A"	366	342	18.01
15	A"	205	192	0.72

Atom	x (Å)	y (Å)	z (Å)
P1	-0.024	0.124	0.000
C2	-0.494	1.666	0.000
F3	1.473	-0.415	0.000
F4	-0.494	-0.696	1.254
F5	-0.494	-0.696	-1.254
H6	-0.515	2.201	-0.933
H7	-0.515	2.201	0.933

	P1	C2	F3	F4	F5	H6	H7
P1		1.6126	1.5903	1.5697	1.5697	2.3299	2.3299
C2	1.6126		2.8631	2.6738	2.6738	1.0756	1.0756
F3	1.5903	2.8631		2.3493	2.3493	3.4151	3.4151
F4	1.5697	2.6738	2.3493		2.5073	3.6295	2.9149
F5	1.5697	2.6738	2.3493	2.5073		2.9149	3.6295
H6	2.3299	1.0756	3.4151	3.6295	2.9149		1.8653
H7	2.3299	1.0756	3.4151	2.9149	3.6295	1.8653

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.794	P1	C2	H7	118.794
C2	P1	F3	126.735	C2	P1	F4	114.318
C2	P1	F5	114.318	F3	P1	F4	96.049
F3	P1	F5	96.049	F4	P1	F5	106.004
H6	C2	H7	120.252

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-)