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	hartrees
Energy at 0K	-679.136806
Energy at 298.15K	-679.140914
HF Energy	-678.211491
Nuclear repulsion energy	250.524756

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	2443	2354
2	A'	1200	1156
3	A'	1178	1134
4	A'	1121	1080
5	A'	843	812
6	A'	750	722
7	A'	530	511
8	A'	418	403
9	A'	284	273
10	A"	2451	2361
11	A"	1184	1140
12	A"	856	824
13	A"	530	511
14	A"	274	264
15	A"	165	159

Atom	x (Å)	y (Å)	z (Å)
C1	0.381	-0.008	0.000
P2	-1.519	-0.100	0.000
F3	0.880	1.243	0.000
F4	0.880	-0.631	1.087
F5	0.880	-0.631	-1.087
H6	-1.636	0.857	-1.040
H7	-1.636	0.857	1.040

	C1	P2	F3	F4	F5	H6	H7
C1		1.9017	1.3474	1.3483	1.3483	2.4286	2.4286
P2	1.9017		2.7494	2.6864	2.6864	1.4183	1.4183
F3	1.3474	2.7494		2.1662	2.1662	2.7499	2.7499
F4	1.3483	2.6864	2.1662		2.1735	3.6149	2.9237
F5	1.3483	2.6864	2.1662	2.1735		2.9237	3.6149
H6	2.4286	1.4183	2.7499	3.6149	2.9237		2.0795
H7	2.4286	1.4183	2.7499	2.9237	3.6149	2.0795

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	P2	H6	92.873	C1	P2	H7	92.873
P2	C1	F3	114.525	P2	C1	F4	110.343
P2	C1	F5	110.343	F3	C1	F4	106.946
F3	C1	F5	106.946	F4	C1	F5	107.424
H6	P2	H7	94.297

All results from a given calculation for CF₃PH₂ (phosphine, (trifluoromethyl)-)

using model chemistry: QCISD(T)/TZVP

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 CF3PH2 (phosphine, (trifluoromethyl)-)

using model chemistry: QCISD(T)/TZVP

States and conformations

All results from a given calculation for CF₃PH₂ (phosphine, (trifluoromethyl)-)