REMARK  Name = BDB035135
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.482  -2.199  -0.328  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1        1.201  -1.608   0.816  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1        1.441  -0.086   0.700  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1        2.153   0.246  -0.548  0.00  0.00    -0.326 N 
ATOM      5  C   LIG    1        1.706  -0.518  -1.741  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1        0.387  -1.287  -1.478  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.500   0.608  -0.549  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1        4.102   1.196  -1.671  0.00  0.00    +0.134 A 
ATOM      9  N   LIG    1        5.401   1.582  -1.778  0.00  0.00    -0.252 NA
ATOM     10  C   LIG    1        6.176   1.389  -0.691  0.00  0.00    +0.090 A 
ATOM     11  C   LIG    1        5.698   0.827   0.481  0.00  0.00    +0.032 A 
ATOM     12  C   LIG    1        4.355   0.439   0.544  0.00  0.00    +0.027 A 
BRANCH  10  13
ATOM     13  C   LIG    1        7.546   1.818  -0.861  0.00  0.00    +0.104 A 
ATOM     14  N   LIG    1        8.002   2.383  -2.021  0.00  0.00    -0.256 N 
ATOM     15  H   LIG    1        7.477   2.568  -2.869  0.00  0.00    +0.191 HD
ATOM     16  N   LIG    1        9.303   2.700  -1.951  0.00  0.00    -0.068 NA
ATOM     17  N   LIG    1        9.728   2.353  -0.744  0.00  0.00    -0.137 NA
ATOM     18  C   LIG    1        8.671   1.814  -0.064  0.00  0.00    +0.165 A 
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -0.745  -2.925  -0.003  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.006   0.742   1.171  0.00  0.00    +0.019 A 
ATOM     21  C   LIG    1       -5.873   0.571  -0.314  0.00  0.00    +0.252 A 
ATOM     22  O   LIG    1       -6.665   1.082  -1.100  0.00  0.00    -0.268 OA
ATOM     23  N   LIG    1       -4.821  -0.185  -0.763  0.00  0.00    -0.321 N 
ATOM     24  H   LIG    1       -4.751  -0.291  -1.766  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1       -3.884  -0.777   0.090  0.00  0.00    +0.068 A 
ATOM     26  C   LIG    1       -3.997  -0.611   1.468  0.00  0.00    +0.088 A 
ATOM     27  N   LIG    1       -3.139  -1.150   2.359  0.00  0.00    -0.253 NA
ATOM     28  C   LIG    1       -2.124  -1.883   1.845  0.00  0.00    +0.116 A 
ATOM     29  C   LIG    1       -1.911  -2.099   0.483  0.00  0.00    -0.013 A 
ATOM     30  C   LIG    1       -2.830  -1.533  -0.410  0.00  0.00    +0.034 A 
ATOM     31  C   LIG    1       -5.100   0.184   1.994  0.00  0.00    +0.038 A 
BRANCH  20  33
ATOM     32  C   LIG    1       -8.472   0.823   1.651  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1       -7.152   1.581   1.668  0.00  0.00    +0.037 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 5