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	hartrees
Energy at 0K	-636.350960
Energy at 298.15K	-636.353242
HF Energy	-635.777027
Nuclear repulsion energy	145.078605

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3317	3113	7.58
2	A'	3286	3085	3.51
3	A'	1785	1676	45.99
4	A'	1416	1329	24.02
5	A'	1302	1222	24.32
6	A'	1122	1053	83.32
7	A'	845	793	16.75
8	A'	675	633	19.99
9	A'	204	191	1.61
10	A"	893	838	0.25
11	A"	779	731	40.10
12	A"	457	429	8.54

Atom	x (Å)	y (Å)
C1	0.000	0.872
C2	1.250	0.425
Cl3	-1.375	-0.167
F4	1.553	-0.883
H5	-0.211	1.933
H6	2.120	1.072

	C1	C2	Cl3	F4	H5	H6
C1		1.3278	1.7242	2.3433	1.0811	2.1290
C2	1.3278		2.6916	1.3425	2.0994	1.0834
Cl3	1.7242	2.6916		3.0141	2.4013	3.7081
F4	2.3433	1.3425	3.0141		3.3222	2.0350
H5	1.0811	2.0994	2.4013	3.3222		2.4846
H6	2.1290	1.0834	3.7081	2.0350	2.4846

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.702	C1	C2	H6	123.685
C2	C1	Cl3	123.229	C2	C1	H5	120.937
Cl3	C1	H5	115.834	F4	C2	H6	113.613

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

using model chemistry: MP3/6-31G*

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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