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	hartrees
Energy at 0K	-277.074421
Energy at 298.15K	-277.076741
HF Energy	-277.074421
Nuclear repulsion energy	111.578012

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3243	3100	0.00
2	A_g	1788	1710	0.00
3	A_g	1324	1266	0.00
4	A_g	1178	1126	0.00
5	A_g	566	541	0.00
6	A_u	912	872	72.06
7	A_u	346	331	4.47
8	B_g	841	804	0.00
9	B_u	3234	3092	13.51
10	B_u	1312	1254	24.53
11	B_u	1200	1147	312.33
12	B_u	325	311	11.77

Atom	x (Å)	y (Å)
C1	-0.329	0.572
C2	0.329	-0.572
F3	0.329	1.734
F4	-0.329	-1.734
H5	-1.405	0.664
H6	1.405	-0.664

	C1	C2	F3	F4	H5	H6
C1		1.3184	1.3352	2.3053	1.0809	2.1292
C2	1.3184		2.3053	1.3352	2.1292	1.0809
F3	1.3352	2.3053		3.5293	2.0375	2.6286
F4	2.3053	1.3352	3.5293		2.6286	2.0375
H5	1.0809	2.1292	2.0375	2.6286		3.1089
H6	2.1292	1.0809	2.6286	2.0375	3.1089

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.621	C1	C2	H6	124.808
C2	C1	F3	120.621	C2	C1	H5	124.808
F3	C1	H5	114.570	F4	C2	H6	114.570

All results from a given calculation for C₂H₂F₂ (Ethene, 1,2-difluoro-, (E)-)

using model chemistry: wB97X-D/cc-pVTZ

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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Number	Element	Mulliken
1	C	0.068
2	C	0.068
3	F	-0.173
4	F	-0.173
5	H	0.105
6	H	0.105

	x	y	z
x	3.660	-0.499	0.000
y	-0.499	4.826	0.000
z	0.000	0.000	2.368

<r²>	79.786
(<r²>)^1/2	8.932

All results from a given calculation for C2H2F2 (Ethene, 1,2-difluoro-, (E)-)

using model chemistry: wB97X-D/cc-pVTZ

States and conformations

All results from a given calculation for C₂H₂F₂ (Ethene, 1,2-difluoro-, (E)-)