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	hartrees
Energy at 0K	-636.501498
Energy at 298.15K	-636.503683
HF Energy	-635.823015
Nuclear repulsion energy	143.300950

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3266	3191
2	A'	3237	3163
3	A'	1721	1681
4	A'	1389	1357
5	A'	1277	1247
6	A'	1092	1067
7	A'	826	807
8	A'	662	646
9	A'	198	194
10	A"	851	832
11	A"	757	740
12	A"	445	434

Atom	x (Å)	y (Å)
C1	0.000	0.882
C2	1.269	0.427
Cl3	-1.393	-0.164
F4	1.570	-0.900
H5	-0.205	1.955
H6	2.148	1.077

	C1	C2	Cl3	F4	H5	H6
C1		1.3477	1.7418	2.3744	1.0927	2.1571
C2	1.3477		2.7263	1.3604	2.1231	1.0938
Cl3	1.7418	2.7263		3.0528	2.4290	3.7524
F4	2.3744	1.3604	3.0528		3.3617	2.0596
H5	1.0927	2.1231	2.4290	3.3617		2.5120
H6	2.1571	1.0938	3.7524	2.0596	2.5120

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.517	C1	C2	H6	123.810
C2	C1	Cl3	123.382	C2	C1	H5	120.556
Cl3	C1	H5	116.062	F4	C2	H6	113.673

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

using model chemistry: MP4/aug-cc-pVDZ

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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