   81
FINAL HEAT OF FORMATION =    -2267.094840
 C     2.362717     3.737194    -0.787360
 C     1.899318     5.011952    -1.063810
 C     1.674777     5.963440    -0.037712
 C     1.922465     5.634620     1.274691
 C     2.405642     4.340461     1.617882
 C     2.628541     3.368956     0.580318
 C     3.112434     2.083911     0.964009
 C     3.370598     1.778748     2.285921
 C     3.150596     2.740232     3.301879
 C     2.676648     3.992146     2.971349
 H     2.503623     4.742822     3.748086
 H     3.358490     2.487058     4.344832
 H     3.749039     0.784991     2.534151
 H     3.288814     1.312715     0.213210
 H     1.754608     6.363288     2.072856
 H     1.306795     6.958637    -0.300036
 H     1.701134     5.308343    -2.095419
 C     2.566675     2.714916    -1.902523
 H     3.462331     2.119674    -1.678524
 C     2.756123     3.297974    -3.308514
 H     1.851071     3.809154    -3.672442
 H     2.986447     2.483509    -4.011731
 H     3.591817     4.014602    -3.326470
 N     1.454248     1.752054    -1.890849
 H     0.533364     2.116893    -1.677511
 C     1.629005     0.414939    -2.047389
 O     2.730957    -0.108064    -2.169349
 C     0.372939    -0.430568    -2.041239
 C    -0.909126     0.086799    -2.266319
 H    -1.090401     1.136266    -2.498049
 C     0.527355    -1.807133    -1.815782
 H     1.523116    -2.231201    -1.685053
 C    -0.603171    -2.616571    -1.740222
 N    -0.440287    -4.060265    -1.449027
 O    -1.431941    -4.665068    -1.073230
 O     0.663930    -4.541071    -1.613531
 C    -1.891569    -2.121808    -1.923190
 H    -2.763404    -2.767778    -1.848278
 C    -2.012276    -0.764958    -2.208182
 N    -3.358623    -0.199876    -2.436950
 O    -4.315613    -0.939758    -2.282060
 O    -3.427106     0.976017    -2.758637
 C    -1.989359     1.711663     2.054368
 C    -2.859891     2.583019     1.446041
 C    -3.999638     2.095584     0.736842
 C    -4.245665     0.733885     0.679231
 C    -3.349457    -0.186337     1.295881
 C    -3.540642    -1.592561     1.221576
 C    -2.629854    -2.470861     1.775639
 H    -2.801817    -3.542684     1.671786
 H    -4.419321    -1.978447     0.697269
 H    -5.107041     0.335815     0.142542
 O    -4.764432     3.047379     0.153855
 C    -5.849358     2.646692    -0.661932
 H    -6.290212     3.567933    -1.066357
 H    -5.509706     2.006685    -1.494585
 H    -6.619405     2.107597    -0.080508
 H    -2.704363     3.663771     1.478111
 H    -1.114338     2.096529     2.585881
 C    -2.194256     0.299907     1.991766
 C    -1.288443    -0.627972     2.567703
 H    -0.406977    -0.239890     3.086469
 C    -1.477799    -1.999095     2.461720
 C    -0.435856    -2.960887     3.052536
 C    -0.838300    -4.438491     3.044347
 H    -0.949522    -4.814185     2.016738
 H    -0.067059    -5.048989     3.538736
 H    -1.785672    -4.588010     3.583672
 H    -0.233280    -2.638940     4.086247
 C     0.865597    -2.760560     2.282781
 O     1.100254    -3.342957     1.225885
 O     1.688261    -1.898823     2.834193
 H     2.494885    -1.748457     2.240543
 C     4.037305    -2.104174     0.265048
 O     3.325013    -3.115959    -0.178496
 H     2.499043    -3.253053     0.382356
 C     5.214864    -1.760430    -0.600418
 H     5.667122    -2.669149    -1.021152
 H     5.949401    -1.179854    -0.028429
 H     4.833752    -1.147421    -1.434297
 O     3.752067    -1.470464     1.281617
