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	hartrees
Energy at 0K	-636.465045
Energy at 298.15K	-636.467145
HF Energy	-635.847992
Nuclear repulsion energy	140.122792

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3278	3115	7.08
2	A'	3268	3105	7.19
3	A'	1708	1623	24.13
4	A'	1337	1271	0.24
5	A'	1261	1199	5.66
6	A'	1172	1114	166.70
7	A'	914	869	50.88
8	A'	458	435	2.15
9	A'	275	261	6.00
10	A"	936	889	64.59
11	A"	791	752	11.44
12	A"	276	262	1.33

Atom	x (Å)	y (Å)
C1	0.000	0.477
C2	1.021	-0.380
Cl3	-1.633	-0.074
F4	2.284	0.065
H5	0.142	1.549
H6	0.931	-1.459

	C1	C2	Cl3	F4	H5	H6
C1		1.3327	1.7233	2.3214	1.0813	2.1488
C2	1.3327		2.6707	1.3399	2.1198	1.0832
Cl3	1.7233	2.6707		3.9196	2.4050	2.9141
F4	2.3214	1.3399	3.9196		2.6066	2.0384
H5	1.0813	2.1198	2.4050	2.6066		3.1104
H6	2.1488	1.0832	2.9141	2.0384	3.1104

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.586	C1	C2	H6	125.292
C2	C1	Cl3	121.311	C2	C1	H5	122.495
Cl3	C1	H5	116.194	F4	C2	H6	114.122

All results from a given calculation for CHFCHCl ((E)-1-chloro-2-fluoroethene)

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

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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