45

C           -2.821835   -0.515466   -0.145975
N           -2.648610   -0.696774   -1.478313
O           -1.890330   -0.524900    0.656972
N           -1.370073   -0.945473   -1.991802
C           -4.236766   -0.286357    0.286187
C           -4.580523   -0.637786    1.594136
C           -5.879492   -0.441208    2.049664
C           -6.837058    0.120740    1.205902
C           -6.491970    0.489931   -0.092888
C           -5.194675    0.287715   -0.555095
H           -3.449539   -0.892801   -2.070067
H           -1.302930   -1.932412   -2.248721
H           -1.263730   -0.402981   -2.849316
H           -3.825951   -1.069933    2.244526
H           -6.145065   -0.723983    3.063788
H           -7.850572    0.276924    1.563648
H           -7.231031    0.943001   -0.746611
H           -4.930112    0.606938   -1.559355
C            1.856468    2.047763    0.110163
C            3.067616    1.278326    0.427588
C            3.037128   -0.097791    0.190552
I            1.158727   -0.729844   -0.574229
C            0.763255    1.350303   -0.411168
C            4.255017    1.816756    0.938527
C            5.346128    0.994198    1.187447
C            5.279178   -0.375466    0.929431
C            4.110896   -0.940200    0.421678
C           -0.431572    1.951605   -0.767061
C           -0.540941    3.329124   -0.587771
C            0.525292    4.060068   -0.063589
C            1.713581    3.430164    0.282064
H            4.324694    2.881431    1.138259
H            6.260249    1.424538    1.583845
H            6.138122   -1.010503    1.122707
H            4.045229   -2.000255    0.207242
H           -1.257289    1.381883   -1.176358
H           -1.465592    3.828859   -0.858772
H            0.428490    5.132196    0.075382
H            2.535546    4.012260    0.687333
C            2.125413   -3.831949    1.039373
O            2.154460   -3.332469   -0.294565
H            3.066270   -3.637417    1.566312
H            1.922166   -4.908191    1.051279
H            1.315837   -3.313073    1.557526
H            2.899599   -3.742883   -0.761961

