
1. A bonding orbital for C1C2 with 1.9827 electrons
__has 51.62% C 1 character in a sp2.59 hybrid
__has 48.38% C 2 character in a sp1.68 hybrid
2. A bonding orbital for C1H3 with 1.9801 electrons
__has 63.77% C 1 character in a sp2.72 hybrid
__has 36.23% H 3 character in a s orbital
3. A bonding orbital for C1Br4 with 1.9904 electrons
__has 47.62% C 1 character in a s0.69 p3 hybrid
__has 52.38% Br 4 character in a s0.42 p3 hybrid
4. A bonding orbital for C1H5 with 1.9802 electrons
__has 63.78% C 1 character in a sp2.72 hybrid
__has 36.22% H 5 character in a s orbital
5. A bonding orbital for C2O6 with 1.9945 electrons
__has 30.78% C 2 character in a sp2.50 hybrid
__has 69.22% O 6 character in a sp2.07 hybrid
6. A bonding orbital for C2O8 with 1.9955 electrons
__has 25.45% C 2 character in a p3 hybrid
__has 74.55% O 8 character in a p3 hybrid
7. A bonding orbital for C2O8 with 1.9941 electrons
__has 33.95% C 2 character in a sp1.89 hybrid
__has 66.05% O 8 character in a sp1.54 hybrid
8. A bonding orbital for O6H7 with 1.9870 electrons
__has 77.30% O 6 character in a s0.87 p3 hybrid
__has 22.70% H 7 character in a s orbital
27. A lone pair orbital for Br4 with 1.9977 electrons
__made from a sp0.14 hybrid
28. A lone pair orbital for Br4 with 1.9894 electrons
__made from a ppi orbital ( 99.98% p)
29. A lone pair orbital for Br4 with 1.9817 electrons
__made from a p3 hybrid
30. A lone pair orbital for O6 with 1.9818 electrons
__made from a sp1.21 hybrid
31. A lone pair orbital for O6 with 1.8670 electrons
__made from a ppi orbital ( 99.85% p 0.15% d)
32. A lone pair orbital for O8 with 1.9805 electrons
__made from a sp0.64 hybrid
33. A lone pair orbital for O8 with 1.8839 electrons
__made from a ppi orbital ( 99.78% p 0.22% d)
123. A antibonding orbital for C2O8 with 0.1520 electrons
__has 74.55% C 2 character in a p3 hybrid
__has 25.45% O 8 character in a p3 hybrid
With core pairs on: C 1 C 2 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 Br 4 O 6 O 8 
The interaction of bonding donor orbital, 1, for C1C2 with the antibonding acceptor orbital, 125, for O6H7 is 21.5 kJ/mol.
The interaction of bonding donor orbital, 2, for C1H3 with the antibonding acceptor orbital, 123, for C2O8 is 24.1 kJ/mol.
The interaction of bonding donor orbital, 4, for C1H5 with the antibonding acceptor orbital, 123, for C2O8 is 23.5 kJ/mol.
The interaction of bonding donor orbital, 8, for O6H7 with the antibonding acceptor orbital, 118, for C1C2 is 28.8 kJ/mol.
The interaction of the third lone pair donor orbital, 29, for Br4 with the antibonding acceptor orbital, 118, for C1C2 is 24.3 kJ/mol.
The interaction of lone pair donor orbital, 30, for O6 with the second antibonding acceptor orbital, 124, for C2O8 is 41.0 kJ/mol.
The interaction of the second lone pair donor orbital, 31, for O6 with the antibonding acceptor orbital, 123, for C2O8 is 261. kJ/mol.
The interaction of the second lone pair donor orbital, 33, for O8 with the antibonding acceptor orbital, 118, for C1C2 is 91.0 kJ/mol.
The interaction of the second lone pair donor orbital, 33, for O8 with the antibonding acceptor orbital, 122, for C2O6 is 162. kJ/mol.
37  1.603
36  0.381
35  1.817
34  1.918
33 ^v 6.853
32 ^v 7.008
31 ^v 7.561
30 ^v 8.467
29 ^v 10.12
28 ^v 10.32
27 ^v 10.57
26 ^v 12.29
25 ^v 12.48
24 ^v 12.55
23 ^v 15.86
22 ^v 18.15
21 ^v 20.70
20 ^v 25.87
19 ^v 28.21
18 ^v 68.38 17 ^v 68.38
16 ^v 68.71 15 ^v 68.71
14 ^v 68.83
13 ^v 171.6 12 ^v 171.6
11 ^v 172.1
10 ^v 229.1
9 ^v 268.6
8 ^v 270.6
7 ^v 506.9
6 ^v 508.4
5 ^v 1517. 4 ^v 1517.
3 ^v 1517.
2 ^v 1680.
1 ^v 13067
Total electronic energy = 2802.5606925866 Hartrees