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	hartrees
Energy at 0K	-834.392273
Energy at 298.15K
HF Energy	-833.475630
Nuclear repulsion energy	293.065243

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1904	1771	47.07
2	A'	1385	1289	173.14
3	A'	1261	1173	206.62
4	A'	1095	1019	242.40
5	A'	708	658	2.91
6	A'	521	484	1.70
7	A'	469	436	1.74
8	A'	345	321	1.66
9	A'	191	178	3.25
10	A"	545	507	3.35
11	A"	376	350	2.75
12	A"	173	161	0.08

Atom	x (Å)	y (Å)
C1	-0.671	-0.680
C2	0.000	0.467
F3	-1.993	-0.756
F4	-0.093	-1.871
F5	-0.673	1.627
Cl6	1.698	0.604

	C1	C2	F3	F4	F5	Cl6
C1		1.3284	1.3242	1.3243	2.3069	2.6942
C2	1.3284		2.3382	2.3399	1.3415	1.7031
F3	1.3242	2.3382		2.2031	2.7242	3.9333
F4	1.3243	2.3399	2.2031		3.5462	3.0553
F5	2.3069	1.3415	2.7242	3.5462		2.5820
Cl6	2.6942	1.7031	3.9333	3.0553	2.5820

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	119.543	C1	C2	Cl6	124.970
C2	C1	F3	123.638	C2	C1	F4	123.790
F3	C1	F4	112.572	F5	C2	Cl6	115.487

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

using model chemistry: MP3/6-31+G**

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: MP3/6-31+G**

States and conformations

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