REMARK  Name = BDB013103
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.238  -0.380  -0.995  0.00  0.00    +0.046 A 
ATOM      2  C   LIG    1        0.143  -1.796  -0.909  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1       -1.111  -2.351  -0.995  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1       -0.919  -3.698  -0.882  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        0.361  -3.957  -0.739  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -2.280  -1.597  -1.162  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1       -2.181  -0.298  -1.261  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        1.033  -2.755  -0.753  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1       -0.928   0.276  -1.184  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        3.869   1.800  -0.687  0.00  0.00    +0.125 A 
ATOM     11  N   LIG    1        2.785   2.232   0.006  0.00  0.00    -0.250 NA
ATOM     12  C   LIG    1        1.645   1.512  -0.117  0.00  0.00    +0.120 A 
ATOM     13  C   LIG    1        1.505   0.379  -0.918  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        2.642  -0.040  -1.616  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1        3.838   0.674  -1.504  0.00  0.00    +0.034 A 
BRANCH  10  19
ATOM     16  C   LIG    1        7.387   3.576   1.381  0.00  0.00    +0.039 C 
ATOM     17  C   LIG    1        6.692   3.984   0.078  0.00  0.00    +0.094 C 
ATOM     18  N   LIG    1        5.258   3.668   0.202  0.00  0.00    -0.239 NA
ATOM     19  C   LIG    1        5.111   2.597  -0.520  0.00  0.00    +0.237 C 
ATOM     20  O   LIG    1        6.177   2.123  -1.217  0.00  0.00    -0.473 OA
ATOM     21  C   LIG    1        7.160   3.146  -1.105  0.00  0.00    +0.260 C 
ATOM     22  C   LIG    1        6.864   5.478  -0.174  0.00  0.00    +0.039 C 
ENDBRANCH  10  19
ENDBRANCH   1  13
BRANCH   6  23
ATOM     23  N   LIG    1       -3.493  -2.243  -1.211  0.00  0.00    -0.310 N 
ATOM     24  H   LIG    1       -3.564  -3.241  -1.061  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -4.766  -1.554  -1.272  0.00  0.00    +0.140 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -5.724  -2.223  -0.323  0.00  0.00    -0.024 A 
ATOM     27  C   LIG    1       -5.681  -1.984   1.048  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1       -4.841  -1.042   1.827  0.00  0.00    +0.080 C 
ATOM     29  C   LIG    1       -5.141  -1.548   3.238  0.00  0.00    +0.234 C 
ATOM     30  O   LIG    1       -6.399  -2.262   3.228  0.00  0.00    -0.491 OA
ATOM     31  C   LIG    1       -6.559  -2.620   1.915  0.00  0.00    +0.124 A 
ATOM     32  C   LIG    1       -7.508  -3.517   1.471  0.00  0.00    +0.046 A 
ATOM     33  C   LIG    1       -7.562  -3.785   0.103  0.00  0.00    +0.004 A 
ATOM     34  C   LIG    1       -6.677  -3.149  -0.785  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 5