REMARK  Name = BDB032243
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.660  -2.625   0.647  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1       -1.948  -2.709   1.788  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.621  -2.445   1.722  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1        0.049  -2.086   0.560  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1       -0.708  -2.024  -0.610  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -2.074  -2.296  -0.567  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1       -4.022  -2.878   0.784  0.00  0.00    -0.321 N 
ATOM      8  H   LIG    1       -4.089  -3.171   1.759  0.00  0.00    +0.148 HD
BRANCH   7  14
ATOM      9  C   LIG    1       -4.360   2.918  -0.949  0.00  0.00    +0.068 C 
ATOM     10  C   LIG    1       -4.265   1.667  -0.164  0.00  0.00    +0.063 A 
ATOM     11  C   LIG    1       -4.860   0.427  -0.411  0.00  0.00    -0.002 A 
ATOM     12  C   LIG    1       -5.729  -0.294  -1.354  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -5.565  -1.789  -0.882  0.00  0.00    +0.033 C 
ATOM     14  C   LIG    1       -4.938  -1.761   0.567  0.00  0.00    +0.121 C 
ATOM     15  C   LIG    1       -4.452  -0.375   0.609  0.00  0.00    +0.060 A 
ATOM     16  N   LIG    1       -3.640   0.346   1.405  0.00  0.00    -0.279 N 
ATOM     17  H   LIG    1       -3.118   0.053   2.226  0.00  0.00    +0.189 HD
ATOM     18  N   LIG    1       -3.518   1.621   0.959  0.00  0.00    -0.179 NA
ENDBRANCH   7  14
ENDBRANCH   1   7
BRANCH   4  19
ATOM     19  C   LIG    1        1.527  -1.807   0.564  0.00  0.00    +0.138 C 
BRANCH  19  20
ATOM     20  N   LIG    1        1.782  -0.485   0.005  0.00  0.00    -0.340 N 
ATOM     21  H   LIG    1        1.085   0.202   0.288  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1        3.075   0.041   0.005  0.00  0.00    +0.028 A 
ATOM     23  C   LIG    1        3.239   1.416  -0.221  0.00  0.00    +0.033 A 
ATOM     24  C   LIG    1        4.511   2.042  -0.306  0.00  0.00    +0.007 A 
ATOM     25  C   LIG    1        5.666   1.236  -0.188  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        6.935   1.865  -0.272  0.00  0.00    +0.124 A 
ATOM     27  N   LIG    1        7.091   3.186  -0.460  0.00  0.00    -0.239 NA
ATOM     28  C   LIG    1        5.975   3.934  -0.574  0.00  0.00    +0.133 A 
ATOM     29  C   LIG    1        5.496  -0.154  -0.001  0.00  0.00    +0.014 A 
ATOM     30  C   LIG    1        4.688   3.426  -0.507  0.00  0.00    +0.067 A 
ATOM     31 CL   LIG    1        3.371   4.533  -0.670  0.00  0.00    -0.081 Cl
ATOM     32  C   LIG    1        4.226  -0.738   0.079  0.00  0.00    +0.023 A 
BRANCH  26  33
ATOM     33  N   LIG    1        8.125   1.130  -0.168  0.00  0.00    -0.343 N 
ATOM     34  H   LIG    1        8.154   0.655   0.729  0.00  0.00    +0.144 HD
ATOM     35  H   LIG    1        8.162   0.437  -0.908  0.00  0.00    +0.144 HD
ENDBRANCH  26  33
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH   4  19
TORSDOF 6