
1. A bonding orbital for C1O2 with 1.9972 electrons
__has 35.56% C 1 character in a sp1.89 hybrid
__has 64.44% O 2 character in a sp1.67 hybrid
2. A bonding orbital for C1O2 with 1.9906 electrons
__has 27.36% C 1 character in a p3 hybrid
__has 72.64% O 2 character in a p3 hybrid
3. A bonding orbital for C1O3 with 1.9964 electrons
__has 32.85% C 1 character in a sp2.46 hybrid
__has 67.15% O 3 character in a sp2.25 hybrid
4. A bonding orbital for C1C5 with 1.9886 electrons
__has 48.79% C 1 character in a sp1.78 hybrid
__has 51.21% C 5 character in a sp2.71 hybrid
5. A bonding orbital for O3H4 with 1.9879 electrons
__has 75.37% O 3 character in a s0.85 p3 hybrid
__has 24.63% H 4 character in a s orbital
6. A bonding orbital for C5Cl6 with 1.9877 electrons
__has 44.93% C 5 character in a s0.79 p3 hybrid
__has 55.07% Cl 6 character in a s0.49 p3 hybrid
7. A bonding orbital for C5H7 with 1.9828 electrons
__has 61.59% C 5 character in a sp2.85 hybrid
__has 38.41% H 7 character in a s orbital
8. A bonding orbital for C5H8 with 1.9897 electrons
__has 61.82% C 5 character in a sp2.76 hybrid
__has 38.18% H 8 character in a s orbital
18. A lone pair orbital for O2 with 1.9776 electrons
__made from a sp0.62 hybrid
19. A lone pair orbital for O2 with 1.8858 electrons
__made from a p3 hybrid
20. A lone pair orbital for O3 with 1.9801 electrons
__made from a sp1.11 hybrid
21. A lone pair orbital for O3 with 1.8732 electrons
__made from a p3 hybrid
22. A lone pair orbital for Cl6 with 1.9981 electrons
__made from a sp0.17 hybrid
23. A lone pair orbital for Cl6 with 1.9833 electrons
__made from a ppi orbital ( 99.98% p)
24. A lone pair orbital for Cl6 with 1.9770 electrons
__made from a p3 hybrid
139. A antibonding orbital for C1O2 with 0.1386 electrons
__has 72.64% C 1 character in a p3 hybrid
__has 27.36% O 2 character in a p3 hybrid
With core pairs on: C 1 O 2 O 3 C 5 Cl 6 Cl 6 Cl 6 Cl 6 Cl 6 
The interaction of bonding donor orbital, 5, for O3H4 with the antibonding acceptor orbital, 141, for C1C5 is 24.7 kJ/mol.
The interaction of bonding donor orbital, 8, for C5H8 with the antibonding acceptor orbital, 140, for C1O3 is 21.3 kJ/mol.
The interaction of the second lone pair donor orbital, 19, for O2 with the antibonding acceptor orbital, 140, for C1O3 is 174. kJ/mol.
The interaction of the second lone pair donor orbital, 19, for O2 with the antibonding acceptor orbital, 141, for C1C5 is 106. kJ/mol.
The interaction of lone pair donor orbital, 20, for O3 with the antibonding acceptor orbital, 138, for C1O2 is 43.0 kJ/mol.
The interaction of the second lone pair donor orbital, 21, for O3 with the second antibonding acceptor orbital, 139, for C1O2 is 235. kJ/mol.
The interaction of the third lone pair donor orbital, 24, for Cl6 with the antibonding acceptor orbital, 141, for C1C5 is 28.6 kJ/mol.
28  1.870
27  0.411
26  0.522
25  2.483
24 ^v 7.011
23 ^v 7.535
22 ^v 7.939
21 ^v 8.484
20 ^v 10.24
19 ^v 10.49
18 ^v 11.20
17 ^v 12.15
16 ^v 12.29
15 ^v 12.84
14 ^v 15.75
13 ^v 18.33
12 ^v 21.72
11 ^v 25.85
10 ^v 28.14
9 ^v 190.3
8 ^v 190.3
7 ^v 190.8
6 ^v 248.8
5 ^v 268.7
4 ^v 270.6
3 ^v 506.9
2 ^v 508.3
1 ^v 2730.
Total electronic energy = 688.8116499297 Hartrees