REMARK  Name = BDB032230
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.990   0.510  -1.728  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1        1.660  -0.690  -1.228  0.00  0.00    -0.223 NA
ATOM      3  C   LIG    1        0.346  -0.961  -1.104  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1       -0.655  -0.082  -1.448  0.00  0.00    +0.006 A 
ATOM      5  C   LIG    1       -0.208   1.124  -1.941  0.00  0.00    +0.121 A 
ATOM      6  N   LIG    1        1.095   1.438  -2.086  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        3.316   0.862  -1.898  0.00  0.00    -0.313 N 
ATOM      8  H   LIG    1        3.349   1.869  -2.008  0.00  0.00    +0.149 HD
BRANCH   7   9
ATOM      9  C   LIG    1        4.285   0.289  -0.982  0.00  0.00    +0.105 C 
BRANCH   9  10
ATOM     10  C   LIG    1        4.187   0.914   0.413  0.00  0.00    +0.026 C 
BRANCH  10  11
ATOM     11  C   LIG    1        5.095   0.217   1.428  0.00  0.00    +0.076 C 
BRANCH  11  14
ATOM     12  C   LIG    1        7.101  -2.083   0.929  0.00  0.00    +0.150 C 
ATOM     13  N   LIG    1        7.412  -0.675   0.878  0.00  0.00    -0.337 N 
ATOM     14  C   LIG    1        6.544   0.370   1.097  0.00  0.00    +0.109 A 
ATOM     15  N   LIG    1        7.172   1.522   0.964  0.00  0.00    -0.241 NA
ATOM     16  C   LIG    1        8.468   1.213   0.653  0.00  0.00    +0.130 A 
ATOM     17  C   LIG    1        8.640  -0.148   0.593  0.00  0.00    +0.106 A 
ENDBRANCH  11  14
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   4  18
ATOM     18  C   LIG    1       -2.107  -0.407  -1.314  0.00  0.00    +0.140 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -2.727   0.491  -0.350  0.00  0.00    -0.340 N 
ATOM     20  H   LIG    1       -2.144   0.665   0.466  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -4.070   0.329   0.000  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1       -5.008  -0.349  -0.789  0.00  0.00    +0.033 A 
ATOM     23  C   LIG    1       -6.385  -0.440  -0.443  0.00  0.00    +0.007 A 
ATOM     24  C   LIG    1       -6.827   0.203   0.735  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1       -8.195   0.101   1.081  0.00  0.00    +0.124 A 
ATOM     26  N   LIG    1       -9.106  -0.554   0.342  0.00  0.00    -0.239 NA
ATOM     27  C   LIG    1       -8.664  -1.150  -0.786  0.00  0.00    +0.133 A 
ATOM     28  C   LIG    1       -5.891   0.929   1.499  0.00  0.00    +0.014 A 
ATOM     29  C   LIG    1       -7.344  -1.129  -1.214  0.00  0.00    +0.067 A 
ATOM     30 CL   LIG    1       -6.954  -1.962  -2.678  0.00  0.00    -0.081 Cl
ATOM     31  C   LIG    1       -4.546   0.997   1.129  0.00  0.00    +0.023 A 
BRANCH  25  32
ATOM     32  N   LIG    1       -8.711   0.696   2.235  0.00  0.00    -0.343 N 
ATOM     33  H   LIG    1       -9.698   0.452   2.268  0.00  0.00    +0.144 HD
ATOM     34  H   LIG    1       -8.223   0.372   3.062  0.00  0.00    +0.144 HD
ENDBRANCH  25  32
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   4  18
TORSDOF 9