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	hartrees
Energy at 0K	-834.997231
Energy at 298.15K
HF Energy	-833.651592
Nuclear repulsion energy	293.228510

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	1818	1769
2	A'	1330	1294
3	A'	1210	1177
4	A'	1059	1031
5	A'	688	670
6	A'	512	498
7	A'	459	447
8	A'	335	326
9	A'	183	178
10	A"	531	517
11	A"	368	358
12	A"	169	165

Atom	x (Å)	y (Å)
C1	-0.680	-0.673
C2	0.000	0.475
F3	-1.998	-0.738
F4	-0.114	-1.864
F5	-0.654	1.642
Cl6	1.704	0.579

	C1	C2	F3	F4	F5	Cl6
C1		1.3342	1.3196	1.3189	2.3147	2.6919
C2	1.3342		2.3373	2.3421	1.3371	1.7067
F3	1.3196	2.3373		2.1947	2.7332	3.9285
F4	1.3189	2.3421	2.1947		3.5471	3.0446
F5	2.3147	1.3371	2.7332	3.5471		2.5858
Cl6	2.6919	1.7067	3.9285	3.0446	2.5858

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	120.111	C1	C2	Cl6	124.101
C2	C1	F3	123.467	C2	C1	F4	123.961
F3	C1	F4	112.572	F5	C2	Cl6	115.788

All results from a given calculation for C₂ClF₃ (Ethene, chlorotrifluoro-)

using model chemistry: MP4/aug-cc-pVTZ

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 C2ClF3 (Ethene, chlorotrifluoro-)

using model chemistry: MP4/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₂ClF₃ (Ethene, chlorotrifluoro-)