REMARK  Name = BDB032232
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.686  -1.193   0.741  0.00  0.00    +0.140 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.198  -1.073   0.683  0.00  0.00    +0.006 A 
ATOM      3  C   LIG    1        0.505  -0.094   1.360  0.00  0.00    +0.121 A 
ATOM      4  N   LIG    1       -0.837   0.030   1.335  0.00  0.00    -0.223 NA
ATOM      5  C   LIG    1       -1.518  -0.861   0.603  0.00  0.00    +0.215 A 
ATOM      6  N   LIG    1       -0.939  -1.849  -0.095  0.00  0.00    -0.223 NA
ATOM      7  C   LIG    1        0.404  -1.935  -0.037  0.00  0.00    +0.121 A 
BRANCH   5   8
ATOM      8  N   LIG    1       -2.899  -0.712   0.608  0.00  0.00    -0.313 N 
ATOM      9  H   LIG    1       -3.050   0.252   0.906  0.00  0.00    +0.149 HD
BRANCH   8  10
ATOM     10  C   LIG    1       -3.537  -1.026  -0.663  0.00  0.00    +0.113 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -5.052  -0.877  -0.547  0.00  0.00    +0.114 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -5.493   0.574  -0.511  0.00  0.00    +0.217 C 
ATOM     13  N   LIG    1       -6.854   0.790  -0.476  0.00  0.00    -0.301 N 
ATOM     14  C   LIG    1       -7.904  -0.216  -0.438  0.00  0.00    +0.108 C 
ATOM     15  C   LIG    1       -9.169   0.570  -0.118  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1       -8.889   1.935  -0.734  0.00  0.00    +0.020 C 
ATOM     17  C   LIG    1       -7.406   2.133  -0.458  0.00  0.00    +0.108 C 
ATOM     18  O   LIG    1       -4.689   1.506  -0.514  0.00  0.00    -0.276 OA
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  19
ATOM     19  N   LIG    1        3.300  -0.004   0.164  0.00  0.00    -0.340 N 
ATOM     20  H   LIG    1        2.821   0.322  -0.675  0.00  0.00    +0.146 HD
BRANCH  19  25
ATOM     21  C   LIG    1        8.922   0.613  -0.278  0.00  0.00    +0.124 A 
ATOM     22  C   LIG    1        7.515   0.464  -0.184  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1        7.002  -0.533   0.680  0.00  0.00    +0.007 A 
ATOM     24  C   LIG    1        5.591  -0.688   0.779  0.00  0.00    +0.033 A 
ATOM     25  C   LIG    1        4.688   0.080   0.035  0.00  0.00    +0.028 A 
ATOM     26  C   LIG    1        5.218   1.081  -0.780  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1        7.925  -1.318   1.401  0.00  0.00    +0.067 A 
ATOM     28 CL   LIG    1        7.448  -2.572   2.491  0.00  0.00    -0.081 Cl
ATOM     29  C   LIG    1        9.281  -1.086   1.232  0.00  0.00    +0.133 A 
ATOM     30  C   LIG    1        6.598   1.264  -0.900  0.00  0.00    +0.014 A 
ATOM     31  N   LIG    1        9.791  -0.144   0.413  0.00  0.00    -0.239 NA
BRANCH  21  32
ATOM     32  N   LIG    1        9.502   1.582  -1.110  0.00  0.00    -0.343 N 
ATOM     33  H   LIG    1        9.193   2.505  -0.823  0.00  0.00    +0.144 HD
ATOM     34  H   LIG    1        9.214   1.424  -2.070  0.00  0.00    +0.144 HD
ENDBRANCH  21  32
ENDBRANCH  19  25
ENDBRANCH   1  19
TORSDOF 8