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	hartrees
Energy at 0K	-636.556644
Energy at 298.15K	-636.558923
HF Energy	-635.845100
Nuclear repulsion energy	145.180195

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3288	3114	8.82
2	A'	3260	3088	5.06
3	A'	1728	1637	56.61
4	A'	1386	1313	22.82
5	A'	1284	1216	30.25
6	A'	1102	1044	94.64
7	A'	839	794	17.40
8	A'	676	640	19.56
9	A'	201	191	1.47
10	A"	881	834	0.02
11	A"	765	724	52.01
12	A"	461	436	11.66

Atom	x (Å)	y (Å)
C1	0.000	0.867
C2	1.251	0.411
Cl3	-1.380	-0.157
F4	1.559	-0.887
H5	-0.197	1.929
H6	2.116	1.064

	C1	C2	Cl3	F4	H5	H6
C1		1.3319	1.7182	2.3460	1.0808	2.1247
C2	1.3319		2.6917	1.3332	2.0988	1.0834
Cl3	1.7182	2.6917		3.0276	2.3984	3.7025
F4	2.3460	1.3332	3.0276		3.3186	2.0286
H5	1.0808	2.0988	2.3984	3.3186		2.4694
H6	2.1247	1.0834	3.7025	2.0286	2.4694

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.354	C1	C2	H6	122.880
C2	C1	Cl3	123.394	C2	C1	H5	120.542
Cl3	C1	H5	116.064	F4	C2	H6	113.766

All results from a given calculation for CHFCHClz ((Z)-1-Chloro-2-fluoroethene)

using model chemistry: MP2=FULL/6-311G*

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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