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	hartrees
Energy at 0K	-79.566321
Energy at 298.15K	-79.572243
HF Energy	-79.242239
Nuclear repulsion energy	42.063783

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_1g	3031	2907
2	A_1g	1452	1393
3	A_1g	1021	979
4	A_1u	317	304
5	A_2u	3029	2905
6	A_2u	1431	1372
7	E_g	3095	2968
7	E_g	3095	2968
8	E_g	1527	1465
8	E_g	1526	1464
9	E_g	1238	1187
9	E_g	1238	1187
10	E_u	3117	2989
10	E_u	3117	2989
11	E_u	1531	1468
11	E_u	1530	1467
12	E_u	826	792
12	E_u	826	792

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.767
C2	0.000	0.000	-0.767
H3	0.000	1.023	1.164
H4	-0.886	-0.511	1.164
H5	0.886	-0.511	1.164
H6	0.000	-1.023	-1.164
H7	-0.886	0.511	-1.164
H8	0.886	0.511	-1.164

	C1	C2	H3	H4	H5	H6	H7	H8
C1		1.5332	1.0971	1.0971	1.0971	2.1849	2.1849	2.1849
C2	1.5332		2.1849	2.1849	2.1849	1.0971	1.0971	1.0971
H3	1.0971	2.1849		1.7711	1.7711	3.0990	2.5431	2.5431
H4	1.0971	2.1849	1.7711		1.7711	2.5431	2.5431	3.0990
H5	1.0971	2.1849	1.7711	1.7711		2.5431	3.0990	2.5431
H6	2.1849	1.0971	3.0990	2.5431	2.5431		1.7711	1.7711
H7	2.1849	1.0971	2.5431	2.5431	3.0990	1.7711		1.7711
H8	2.1849	1.0971	2.5431	3.0990	2.5431	1.7711	1.7711

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	111.250	C1	C2	H7	111.250
C1	C2	H8	111.250	C2	C1	H3	111.250
C2	C1	H4	111.250	C2	C1	H5	111.250
H3	C1	H4	107.636	H3	C1	H5	107.636
H4	C1	H5	107.636	H6	C2	H7	107.636
H6	C2	H8	107.636	H7	C2	H8	107.636

All results from a given calculation for C₂H₆ (Ethane)

using model chemistry: MP4/6-311G*

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: MP4/6-311G*

States and conformations

All results from a given calculation for C₂H₆ (Ethane)