   60
TEG-DMBI radical B3LYP/6-311G* optimized structure
 C     0.000000    -0.000000     0.000000
 C    -0.898107    -1.006217    -0.461746
 C    -0.307758    -2.085523    -1.191837
 C     1.048714    -2.144359    -1.426590
 C     1.907432    -1.132156    -0.966577
 C     1.363881    -0.058414    -0.253699
 C    -2.294633    -0.937739    -0.221883
 N    -3.071819     0.225518    -0.088386
 C    -4.391093    -0.128147     0.161307
 C    -4.457449    -1.534404     0.185461
 N    -3.175863    -2.017005    -0.041995
 C    -5.658578    -2.193090     0.416090
 C    -6.805351    -1.405949     0.618006
 C    -6.741921    -0.017659     0.581245
 C    -5.526201     0.649470     0.352118
 C    -2.713315     1.533258    -0.610140
 C    -2.781186    -3.367866     0.315570
 O     3.237008    -1.285527    -1.269200
 C     4.154326    -0.313070    -0.795751
 C     5.535602    -0.759597    -1.241051
 O     6.459451     0.200548    -0.766879
 C     7.801444    -0.098485    -1.101736
 C     8.675255     0.997449    -0.517923
 O    10.017278     0.692247    -0.841929
 C    10.942386     1.643549    -0.349642
 C    12.332338     1.191027    -0.760063
 O    13.254530     2.141245    -0.266638
 C    14.602942     1.831819    -0.581249
 C    15.492588     2.916333    -0.002496
 H    -5.479461     1.732592     0.345105
 H    -0.942009    -2.856283    -1.614792
 H     1.476824    -2.962223    -1.996837
 H     1.997942     0.732762     0.128709
 H    -0.376601     0.815016     0.607506
 H    -7.643401     0.565778     0.736267
 H    -7.756515    -1.895747     0.798520
 H    -5.720518    -3.275438     0.419927
 H    -1.742657    -3.372890     0.641593
 H    -3.406330    -3.719538     1.140070
 H    -2.889119    -4.063068    -0.523017
 H    -3.532915     1.916849    -1.223848
 H    -1.824276     1.448913    -1.231308
 H    -2.514114     2.251107     0.191695
 H     4.122604    -0.240971     0.298065
 H     3.930446     0.676591    -1.212382
 H     5.570911    -0.832321    -2.337210
 H     5.757041    -1.754594    -0.830182
 H     7.934346    -0.140669    -2.192099
 H     8.101291    -1.072152    -0.689037
 H     8.534436     1.044055     0.571412
 H     8.381276     1.970945    -0.935832
 H    10.883709     1.717556     0.745549
 H    10.738022     2.640829    -0.764447
 H    12.390109     1.116367    -1.855907
 H    12.534562     0.192216    -0.346214
 H    14.726687     1.767311    -1.673346
 H    14.867253     0.847369    -0.165079
 H    15.234839     3.890115    -0.425316
 H    16.544103     2.711885    -0.221785
 H    15.370825     2.973749     1.081649
