REMARK  Name = BDB015890
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.339   1.839  -0.278  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.364   0.800   0.210  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.706   0.853   0.178  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -2.374   1.967  -0.333  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -1.560   2.991  -0.785  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1       -0.212   2.962  -0.765  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.834   0.340  -0.004  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.438   0.488  -0.003  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.810   1.720  -0.281  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.642   2.817  -0.566  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.033   2.690  -0.569  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.625   1.458  -0.290  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        6.986  -3.245   1.385  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.830  -2.531   0.901  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.737  -3.220   0.526  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.885  -2.264   0.146  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.424  -0.960   0.276  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.692  -1.179   0.774  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.819   2.074  -0.422  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -4.549   3.216  -0.162  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.860   2.883  -0.355  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -7.008   3.745  -0.205  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -6.038   1.602  -0.719  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.796   1.113  -0.769  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.439  -0.246   0.676  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -3.101   0.111   1.364  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.667  -1.381   1.206  0.00  0.00    +0.142 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -1.356  -2.456   0.152  0.00  0.00    +0.128 C 
ATOM     29  C   LIG    1       -1.088  -3.851   0.759  0.00  0.00    +0.198 C 
ATOM     30  O   LIG    1       -2.126  -4.448  -0.056  0.00  0.00    -0.374 OA
ATOM     31  C   LIG    1       -2.608  -3.136  -0.439  0.00  0.00    +0.198 C 
BRANCH  28  32
ATOM     32  O   LIG    1       -0.354  -2.012  -0.806  0.00  0.00    -0.382 OA
ATOM     33  H   LIG    1       -0.331  -2.708  -1.486  0.00  0.00    +0.210 HD
ENDBRANCH  28  32
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 7