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	hartrees
Energy at 0K	-78.450206
Energy at 298.15K	-78.456050
HF Energy	-78.302982
Nuclear repulsion energy	41.485654

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_1g	3298	3298
2	A_1g	1614	1614
3	A_1g	1104	1104
4	A_1u	294	294
5	A_2u	3300	3300
6	A_2u	1579	1579
7	E_g	3456	3456
7	E_g	3456	3456
8	E_g	1694	1694
8	E_g	1693	1693
9	E_g	1346	1346
9	E_g	1346	1346
10	E_u	3468	3468
10	E_u	3468	3468
11	E_u	1710	1710
11	E_u	1709	1709
12	E_u	903	903
12	E_u	903	903

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.781
C2	0.000	0.000	-0.781
H3	0.000	1.038	1.173
H4	-0.899	-0.519	1.173
H5	0.899	-0.519	1.173
H6	0.000	-1.038	-1.173
H7	-0.899	0.519	-1.173
H8	0.899	0.519	-1.173

	C1	C2	H3	H4	H5	H6	H7	H8
C1		1.5610	1.1101	1.1101	1.1101	2.2127	2.2127	2.2127
C2	1.5610		2.2127	2.2127	2.2127	1.1101	1.1101	1.1101
H3	1.1101	2.2127		1.7983	1.7983	3.1337	2.5663	2.5663
H4	1.1101	2.2127	1.7983		1.7983	2.5663	2.5663	3.1337
H5	1.1101	2.2127	1.7983	1.7983		2.5663	3.1337	2.5663
H6	2.2127	1.1101	3.1337	2.5663	2.5663		1.7983	1.7983
H7	2.2127	1.1101	2.5663	2.5663	3.1337	1.7983		1.7983
H8	2.2127	1.1101	2.5663	3.1337	2.5663	1.7983	1.7983

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	110.729	C1	C2	H7	110.729
C1	C2	H8	110.729	C2	C1	H3	110.729
C2	C1	H4	110.729	C2	C1	H5	110.729
H3	C1	H4	108.184	H3	C1	H5	108.184
H4	C1	H5	108.184	H6	C2	H7	108.184
H6	C2	H8	108.184	H7	C2	H8	108.184

All results from a given calculation for C₂H₆ (Ethane)

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

using model chemistry: MP4=FULL/STO-3G

States and conformations

All results from a given calculation for C₂H₆ (Ethane)