39
C4H18B16O << C1 >> E(RHF) / 6-31G(d) = -631.97572  2,2'-(1,10-C2B8H9)2O
C -2.478082 -1.655668 0.000031
B -1.277518 -0.593085 -0.000096
B -2.609031 -0.746949 1.308422
B -3.888385 -0.902874 0.000146
B -2.609276 -0.747012 -1.308389
B -1.873635 0.861555 0.924732
B -3.696586 0.637822 0.925125
B -3.696736 0.637790 -0.924956
B -1.873792 0.861504 -0.924888
C -2.891987 1.670449 -0.000014
H -2.330506 -2.729354 0.000054
O 0.027263 -1.070380 -0.000159
H -2.555635 -1.232065 2.391619
H -4.899358 -1.525879 0.000213
H -2.556057 -1.232195 -2.391565
H -1.170944 1.431594 1.695796
H -4.508635 1.039033 1.694169
H -4.508984 1.038930 -1.693828
H -1.171254 1.431499 -1.696132
H -3.029743 2.744788 -0.000009
B 1.233721 -0.377575 -0.000278
B 2.131588 0.615519 1.308985
B 2.988009 1.574956 0.000105
B 2.131980 0.615642 -1.309127
B 2.640161 -1.077076 0.924404
B 3.863273 0.292967 0.925517
B 3.863360 0.293036 -0.925108
B 2.640269 -1.076859 -0.924347
C 3.939444 -1.011283 -0.000012
C 1.428591 1.213269 -0.000096
H 0.637636 1.952588 -0.000447
H 1.772017 0.949257 2.391613
H 3.329447 2.712707 0.000426
H 1.772849 0.949300 -2.391922
H 2.476478 -1.973713 1.686142
H 4.737558 0.532759 1.693726
H 4.738031 0.532785 -1.692912
H 2.477045 -1.973634 -1.686046
H 4.747143 -1.732760 -0.000317
