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	hartrees
Energy at 0K	-797.002693
Energy at 298.15K
HF Energy	-795.836261
Nuclear repulsion energy	250.669066

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1129	1129
2	A₁	791	791
3	A₁	479	479
4	E	1257	1257
4	E	1257	1257
5	E	567	567
5	E	567	567
6	E	351	351
6	E	350	350

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.350
Cl2	0.000	0.000	1.409
F3	0.000	1.243	-0.809
F4	1.076	-0.621	-0.809
F5	-1.076	-0.621	-0.809

	C1	Cl2	F3	F4	F5
C1		1.7589	1.3248	1.3248	1.3248
Cl2	1.7589		2.5424	2.5424	2.5424
F3	1.3248	2.5424		2.1525	2.1525
F4	1.3248	2.5424	2.1525		2.1525
F5	1.3248	2.5424	2.1525	2.1525

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	F3	110.273	Cl2	C1	F4	110.273
Cl2	C1	F5	110.273	F3	C1	F4	108.657
F3	C1	F5	108.657	F4	C1	F5	108.657

All results from a given calculation for CF₃Cl (Methane, chlorotrifluoro-)

using model chemistry: QCISD(T)/cc-pCVTZ

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 CF3Cl (Methane, chlorotrifluoro-)

using model chemistry: QCISD(T)/cc-pCVTZ

States and conformations

All results from a given calculation for CF₃Cl (Methane, chlorotrifluoro-)