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	hartrees
Energy at 0K	-833.955103
Energy at 298.15K
HF Energy	-833.377176
Nuclear repulsion energy	281.220323

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	1755	1694	30.00	1.44	0.62	0.76
2	A'	1186	1145	144.78	0.43	0.62	0.76
3	A'	1093	1056	139.79	0.25	0.37	0.54
4	A'	954	921	169.53	1.04	0.07	0.13
5	A'	611	589	3.07	9.25	0.18	0.31
6	A'	468	451	2.12	3.16	0.73	0.85
7	A'	409	395	3.17	3.65	0.34	0.51
8	A'	306	296	1.75	3.68	0.69	0.82
9	A'	176	170	5.05	0.73	0.70	0.82
10	A"	485	469	3.99	10.46	0.75	0.86
11	A"	341	329	5.47	0.45	0.75	0.86
12	A"	159	153	0.07	0.08	0.75	0.86

Atom	x (Å)	y (Å)
C1	-0.714	-0.671
C2	0.000	0.479
F3	-2.100	-0.728
F4	-0.142	-1.936
F5	-0.662	1.718
Cl6	1.789	0.569

	C1	C2	F3	F4	F5	Cl6
C1		1.3535	1.3872	1.3877	2.3903	2.7936
C2	1.3535		2.4219	2.4187	1.4053	1.7916
F3	1.3872	2.4219		2.3003	2.8379	4.0998
F4	1.3877	2.4187	2.3003		3.6910	3.1630
F5	2.3903	1.4053	2.8379	3.6910		2.7072
Cl6	2.7936	1.7916	4.0998	3.1630	2.7072

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	120.081	C1	C2	Cl6	124.718
C2	C1	F3	124.171	C2	C1	F4	123.846
F3	C1	F4	111.983	F5	C2	Cl6	115.201

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

using model chemistry: MP2/SDD

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: MP2/SDD

States and conformations

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