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	hartrees
Energy at 0K	-277.728019
Energy at 298.15K
HF Energy	-276.963909
Nuclear repulsion energy	124.338027

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3069	3069
2	A_g	1498	1498
3	A_g	1429	1429
4	A_g	1103	1103
5	A_g	1035	1035
6	A_g	450	450
7	A_u	3147	3147
8	A_u	1217	1217
9	A_u	802	802
10	A_u	116	116
11	B_g	3124	3124
12	B_g	1280	1280
13	B_g	1160	1160
14	B_u	3072	3072
15	B_u	1504	1504
16	B_u	1336	1336
17	B_u	1046	1046
18	B_u	275	275

Atom	x (Å)	y (Å)	z (Å)
C1	0.432	0.628	0.000
C2	-0.432	-0.628	0.000
F3	-0.432	1.740	0.000
F4	0.432	-1.740	0.000
H5	1.061	0.680	0.903
H6	1.061	0.680	-0.903
H7	-1.061	-0.680	0.903
H8	-1.061	-0.680	-0.903

	C1	C2	F3	F4	H5	H6	H7	H8
C1		1.5243	1.4089	2.3682	1.1018	1.1018	2.1805	2.1805
C2	1.5243		2.3682	1.4089	2.1805	2.1805	1.1018	1.1018
F3	1.4089	2.3682		3.5865	2.0422	2.0422	2.6585	2.6585
F4	2.3682	1.4089	3.5865		2.6585	2.6585	2.0422	2.0422
H5	1.1018	2.1805	2.0422	2.6585		1.8067	2.5198	3.1006
H6	1.1018	2.1805	2.0422	2.6585	1.8067		3.1006	2.5198
H7	2.1805	1.1018	2.6585	2.0422	2.5198	3.1006		1.8067
H8	2.1805	1.1018	2.6585	2.0422	3.1006	2.5198	1.8067

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	107.612	C1	C2	H7	111.243
C1	C2	H8	111.243	C2	C1	F3	107.612
C2	C1	H5	111.243	C2	C1	H6	111.243
F3	C1	H5	108.234	F3	C1	H6	108.234
F4	C2	H7	108.234	F4	C2	H8	108.234
H5	C1	H6	110.146	H7	C2	H8	110.146

All results from a given calculation for C₂H₄F₂ (1,2-difluoroethane)

using model chemistry: CCSD(T)=FULL/daug-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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All results from a given calculation for C2H4F2 (1,2-difluoroethane)

using model chemistry: CCSD(T)=FULL/daug-cc-pVDZ

States and conformations

All results from a given calculation for C₂H₄F₂ (1,2-difluoroethane)