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	hartrees
Energy at 0K	-273.101334
Energy at 298.15K	-273.103257
HF Energy	-273.101334
Nuclear repulsion energy	107.059073

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3249	3006	0.00
2	A_g	1742	1612	0.00
3	A_g	1323	1224	0.00
4	A_g	1180	1092	0.00
5	A_g	532	492	0.00
6	A_u	914	845	28.65
7	A_u	297	275	0.09
8	B_g	688	636	0.00
9	B_u	3242	2999	16.84
10	B_u	1363	1261	34.24
11	B_u	1228	1136	51.11
12	B_u	297	275	1.79

Atom	x (Å)	y (Å)
C1	-0.333	0.604
C2	0.333	-0.604
F3	0.333	1.818
F4	-0.333	-1.818
H5	-1.448	0.662
H6	1.448	-0.662

	C1	C2	F3	F4	H5	H6
C1		1.3785	1.3843	2.4211	1.1166	2.1846
C2	1.3785		2.4211	1.3843	2.1846	1.1166
F3	1.3843	2.4211		3.6954	2.1224	2.7189
F4	2.4211	1.3843	3.6954		2.7189	2.1224
H5	1.1166	2.1846	2.1224	2.7189		3.1841
H6	2.1846	1.1166	2.7189	2.1224	3.1841

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.402	C1	C2	H6	121.874
C2	C1	F3	122.402	C2	C1	H5	121.874
F3	C1	H5	115.724	F4	C2	H6	115.724

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

using model chemistry: BLYP/STO-3G

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	-0.033
2	C	-0.033
3	F	-0.039
4	F	-0.039
5	H	0.072
6	H	0.072

	x	y	z
x	2.020	-0.199	0.000
y	-0.199	3.589	0.000
z	0.000	0.000	0.441

<r²>	84.234
(<r²>)^1/2	9.178

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

using model chemistry: BLYP/STO-3G

States and conformations

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