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	hartrees
Energy at 0K	-834.352143
Energy at 298.15K
HF Energy	-833.458898
Nuclear repulsion energy	292.883599

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'	1871	1765	44.52	8.32	0.41	0.58
2	A'	1388	1309	155.06	0.03	0.33	0.50
3	A'	1260	1188	186.01	0.52	0.23	0.37
4	A'	1090	1028	224.91	2.13	0.16	0.27
5	A'	701	661	3.18	6.76	0.14	0.24
6	A'	517	487	1.11	1.62	0.75	0.85
7	A'	466	439	0.99	2.09	0.40	0.57
8	A'	341	321	1.26	2.45	0.64	0.78
9	A'	188	177	3.12	0.51	0.64	0.78
10	A"	520	490	3.30	9.47	0.75	0.86
11	A"	375	354	1.93	0.32	0.75	0.86
12	A"	173	163	0.04	0.05	0.75	0.86

Atom	x (Å)	y (Å)
C1	-0.670	-0.680
C2	0.000	0.472
F3	-1.995	-0.747
F4	-0.088	-1.870
F5	-0.677	1.632
Cl6	1.697	0.595

	C1	C2	F3	F4	F5	Cl6
C1		1.3330	1.3260	1.3251	2.3126	2.6894
C2	1.3330		2.3379	2.3442	1.3433	1.7019
F3	1.3260	2.3379		2.2128	2.7205	3.9286
F4	1.3251	2.3442	2.2128		3.5520	3.0442
F5	2.3126	1.3433	2.7205	3.5520		2.5908
Cl6	2.6894	1.7019	3.9286	3.0442	2.5908

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	119.563	C1	C2	Cl6	124.338
C2	C1	F3	123.099	C2	C1	F4	123.741
F3	C1	F4	113.160	F5	C2	Cl6	116.099

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

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

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