REMARK  Name = BDB024767
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.299  -3.728  -0.207  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        4.164  -2.370   0.137  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        5.387  -1.577   0.384  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        5.946  -1.008  -0.927  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        5.172  -0.506   1.449  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        4.065   0.436   1.039  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        2.837  -0.319   0.618  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        1.589   0.346   0.630  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1        1.304   1.644   0.985  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        0.002   1.790   0.839  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1       -0.566   0.620   0.383  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1        0.434  -0.316   0.244  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        0.445  -1.641  -0.178  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        1.688  -2.292  -0.202  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        2.891  -1.673   0.183  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        3.397  -4.538  -0.383  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1        5.812  -5.474  -0.673  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1        5.611  -4.103  -0.330  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1       -1.974   0.399   0.080  0.00  0.00    +0.139 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.278   0.689  -1.397  0.00  0.00    +0.106 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.673   0.658  -1.850  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1       -4.519   1.684  -1.256  0.00  0.00    +0.105 C 
BRANCH  21  23
ATOM     23  C   LIG    1       -4.294  -0.678  -1.928  0.00  0.00    +0.180 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -4.721  -1.329  -0.597  0.00  0.00    +0.229 C 
ATOM     25  N   LIG    1       -5.178  -2.648  -0.668  0.00  0.00    -0.307 N 
ATOM     26  C   LIG    1       -5.126  -3.469  -1.869  0.00  0.00    +0.131 C 
ATOM     27  C   LIG    1       -5.449  -3.355   0.575  0.00  0.00    +0.131 C 
ATOM     28  O   LIG    1       -4.671  -0.730   0.479  0.00  0.00    -0.274 OA
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  29
ATOM     29  C   LIG    1       -0.773   3.042   1.104  0.00  0.00    +0.097 C 
BRANCH  29  30
ATOM     30  C   LIG    1        0.122   4.165   1.617  0.00  0.00    +0.151 C 
BRANCH  30  31
ATOM     31  N   LIG    1       -0.604   5.417   1.733  0.00  0.00    -0.271 N 
ATOM     32  N   LIG    1       -1.613   5.531   2.618  0.00  0.00    -0.180 NA
ATOM     33  C   LIG    1       -2.038   6.786   2.453  0.00  0.00    +0.134 A 
ATOM     34  C   LIG    1       -1.313   7.471   1.462  0.00  0.00    +0.041 A 
ATOM     35  C   LIG    1       -0.391   6.557   1.011  0.00  0.00    +0.108 A 
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  10  29
TORSDOF 9