REMARK  Name = BDB035707
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.859  -0.586  -0.063  0.00  0.00    -0.263 N 
ATOM      2  C   LIG    1       -0.256  -1.425  -0.166  0.00  0.00    +0.251 C 
ATOM      3  O   LIG    1       -0.362  -2.635  -0.099  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -1.421  -0.564  -0.401  0.00  0.00    +0.044 A 
ATOM      5  C   LIG    1       -0.991   0.756  -0.437  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -1.904   1.769  -0.646  0.00  0.00    +0.047 A 
ATOM      7  C   LIG    1       -3.252   1.437  -0.818  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -3.684   0.090  -0.783  0.00  0.00    -0.031 A 
ATOM      9 CL   LIG    1       -1.408   3.413  -0.696  0.00  0.00    -0.083 Cl
ATOM     10  C   LIG    1       -2.746  -0.929  -0.567  0.00  0.00    +0.018 A 
ATOM     11  C   LIG    1        0.480   0.813  -0.224  0.00  0.00    +0.151 C 
ENDROOT
BRANCH   1  14
ATOM     12  C   LIG    1        4.578  -0.400   0.468  0.00  0.00    -0.035 A 
ATOM     13  C   LIG    1        3.237  -0.034   0.232  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1        2.203  -0.986   0.181  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1        2.546  -2.327   0.382  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        3.868  -2.707   0.635  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1        4.877  -1.750   0.682  0.00  0.00    +0.004 A 
BRANCH  12  18
ATOM     18  C   LIG    1        5.658   0.679   0.505  0.00  0.00    +0.087 C 
BRANCH  18  19
ATOM     19  C   LIG    1        6.964   0.263  -0.124  0.00  0.00    +0.140 A 
ATOM     20  N   LIG    1        7.128  -0.066  -1.449  0.00  0.00    -0.320 N 
ATOM     21  C   LIG    1        6.131  -0.098  -2.485  0.00  0.00    +0.151 C 
ATOM     22  C   LIG    1        8.444  -0.375  -1.606  0.00  0.00    +0.224 A 
ATOM     23  N   LIG    1        9.066  -0.237  -0.461  0.00  0.00    -0.138 NA
ATOM     24  N   LIG    1        8.140   0.168   0.469  0.00  0.00    -0.134 NA
ENDBRANCH  18  19
BRANCH  18  26
ATOM     25  C   LIG    1        6.181   0.314   3.033  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1        5.827   1.290   1.915  0.00  0.00    +0.012 C 
ENDBRANCH  18  26
ENDBRANCH  12  18
ENDBRANCH   1  14
BRANCH   8  27
ATOM     27  C   LIG    1       -5.151  -0.236  -0.958  0.00  0.00    +0.117 C 
BRANCH  27  28
ATOM     28  N   LIG    1       -5.905   0.203   0.215  0.00  0.00    -0.307 NA
ATOM     29  H   LIG    1       -5.564  -0.303   1.033  0.00  0.00    +0.123 HD
BRANCH  28  30
ATOM     30  C   LIG    1       -7.359   0.100   0.020  0.00  0.00    +0.017 C 
ATOM     31  C   LIG    1       -8.022   0.892   1.186  0.00  0.00    +0.022 C 
ATOM     32  C   LIG    1       -8.935   1.552   0.132  0.00  0.00    +0.004 C 
ATOM     33  C   LIG    1       -7.845   1.243  -0.916  0.00  0.00    +0.022 C 
ATOM     34  C   LIG    1       -7.883  -1.307  -0.195  0.00  0.00    +0.027 C 
ENDBRANCH  28  30
ENDBRANCH  27  28
ENDBRANCH   8  27
TORSDOF 7