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	hartrees
Energy at 0K	-678.954677
Energy at 298.15K	-678.958464
HF Energy	-678.110535
Nuclear repulsion energy	268.849885

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3219	3088	11.93
2	A'	1383	1327	68.51
3	A'	1158	1111	202.95
4	A'	883	847	173.67
5	A'	797	765	78.30
6	A'	513	492	59.10
7	A'	453	434	66.02
8	A'	340	326	59.75
9	A'	246	236	1.71
10	A"	3336	3201	7.40
11	A"	988	948	205.88
12	A"	817	783	0.02
13	A"	449	431	0.04
14	A"	353	339	22.65
15	A"	202	194	1.00

Atom	x (Å)	y (Å)	z (Å)
P1	-0.022	0.133	0.000
C2	-0.503	1.688	0.000
F3	1.487	-0.439	0.000
F4	-0.503	-0.701	1.266
F5	-0.503	-0.701	-1.266
H6	-0.491	2.228	-0.948
H7	-0.491	2.228	0.948

	P1	C2	F3	F4	F5	H6	H7
P1		1.6275	1.6139	1.5900	1.5900	2.3474	2.3474
C2	1.6275		2.9125	2.7032	2.7032	1.0918	1.0918
F3	1.6139	2.9125		2.3725	2.3725	3.4535	3.4535
F4	1.5900	2.7032	2.3725		2.5319	3.6719	2.9462
F5	1.5900	2.7032	2.3725	2.5319		2.9462	3.6719
H6	2.3474	1.0918	3.4535	3.6719	2.9462		1.8970
H7	2.3474	1.0918	3.4535	2.9462	3.6719	1.8970

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.026	P1	C2	H7	118.026
C2	P1	F3	127.928	C2	P1	F4	114.311
C2	P1	F5	114.311	F3	P1	F4	95.547
F3	P1	F5	95.547	F4	P1	F5	105.537
H6	C2	H7	120.626

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

using model chemistry: QCISD/cc-pVDZ

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/cc-pVDZ

States and conformations

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