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	hartrees
Energy at 0K	-14.754338
Energy at 298.15K	-14.760233
HF Energy	-14.464369
Nuclear repulsion energy	26.158275

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_1g	3047	3047
2	A_1g	1450	1450
3	A_1g	1023	1023
4	A_1u	312	312
5	A_2u	3042	3042
6	A_2u	1412	1412
7	E_g	3111	3111
7	E_g	3110	3110
8	E_g	1507	1507
8	E_g	1506	1506
9	E_g	1225	1225
9	E_g	1225	1225
10	E_u	3132	3132
10	E_u	3132	3132
11	E_u	1508	1508
11	E_u	1507	1507
12	E_u	819	819
12	E_u	819	819

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.777
C2	0.000	0.000	-0.777
H3	0.000	1.036	1.174
H4	-0.897	-0.518	1.174
H5	0.897	-0.518	1.174
H6	0.000	-1.036	-1.174
H7	-0.897	0.518	-1.174
H8	0.897	0.518	-1.174

	C1	C2	H3	H4	H5	H6	H7	H8
C1		1.5539	1.1097	1.1097	1.1097	2.2093	2.2093	2.2093
C2	1.5539		2.2093	2.2093	2.2093	1.1097	1.1097	1.1097
H3	1.1097	2.2093		1.7947	1.7947	3.1322	2.5670	2.5670
H4	1.1097	2.2093	1.7947		1.7947	2.5670	2.5670	3.1322
H5	1.1097	2.2093	1.7947	1.7947		2.5670	3.1322	2.5670
H6	2.2093	1.1097	3.1322	2.5670	2.5670		1.7947	1.7947
H7	2.2093	1.1097	2.5670	2.5670	3.1322	1.7947		1.7947
H8	2.2093	1.1097	2.5670	3.1322	2.5670	1.7947	1.7947

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	110.983	C1	C2	H7	110.983
C1	C2	H8	110.983	C2	C1	H3	110.983
C2	C1	H4	110.983	C2	C1	H5	110.983
H3	C1	H4	107.918	H3	C1	H5	107.918
H4	C1	H5	107.918	H6	C2	H7	107.918
H6	C2	H8	107.918	H7	C2	H8	107.918

All results from a given calculation for C₂H₆ (Ethane)

using model chemistry: MP4=FULL/CEP-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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All results from a given calculation for C2H6 (Ethane)

using model chemistry: MP4=FULL/CEP-31G*

States and conformations

All results from a given calculation for C₂H₆ (Ethane)