REMARK  Name = BDB031736
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.212  -1.035  -2.009  0.00  0.00    -0.041 A 
ATOM      2  C   LIG    1       -0.612  -1.650  -0.895  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1        0.613  -1.156  -0.432  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1        1.282  -0.096  -1.028  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        2.474   0.082  -0.251  0.00  0.00    +0.152 A 
ATOM      6  N   LIG    1        2.527  -0.808   0.747  0.00  0.00    -0.158 NA
ATOM      7  C   LIG    1        0.699   0.510  -2.157  0.00  0.00    +0.014 A 
ATOM      8  N   LIG    1        1.406  -1.529   0.615  0.00  0.00    -0.275 N 
ATOM      9  H   LIG    1        1.236  -2.273   1.281  0.00  0.00    +0.189 HD
ATOM     10  C   LIG    1       -0.532   0.028  -2.629  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   1  15
ATOM     11  C   LIG    1       -3.723   0.435   1.649  0.00  0.00    +0.120 A 
ATOM     12  C   LIG    1       -3.378   0.174   0.315  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1       -3.944  -0.911  -0.338  0.00  0.00    -0.007 A 
ATOM     14  C   LIG    1       -3.812  -1.468  -1.727  0.00  0.00    +0.081 C 
ATOM     15  C   LIG    1       -2.535  -1.538  -2.540  0.00  0.00    +0.040 C 
ATOM     16  C   LIG    1       -4.770  -2.637  -1.746  0.00  0.00    +0.228 C 
ATOM     17  N   LIG    1       -5.335  -2.719  -0.486  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1       -6.019  -3.418  -0.241  0.00  0.00    +0.155 HD
ATOM     19  O   LIG    1       -4.984  -3.360  -2.704  0.00  0.00    -0.274 OA
ATOM     20  C   LIG    1       -3.640  -0.574  -2.921  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -4.865  -1.709   0.356  0.00  0.00    +0.038 A 
ATOM     22  C   LIG    1       -5.230  -1.483   1.666  0.00  0.00    +0.027 A 
ATOM     23  C   LIG    1       -4.644  -0.393   2.317  0.00  0.00    +0.047 A 
BRANCH  11  25
ATOM     24  C   LIG    1       -3.373   1.828   3.549  0.00  0.00    +0.277 C 
ATOM     25  O   LIG    1       -3.096   1.527   2.187  0.00  0.00    -0.495 OA
ENDBRANCH  11  25
ENDBRANCH   1  15
BRANCH   5  26
ATOM     26  N   LIG    1        3.384   1.049  -0.552  0.00  0.00    -0.295 N 
ATOM     27  H   LIG    1        3.149   1.625  -1.352  0.00  0.00    +0.154 HD
BRANCH  26  28
ATOM     28  C   LIG    1        4.554   1.348   0.069  0.00  0.00    +0.073 A 
ATOM     29  C   LIG    1        5.463   2.381  -0.294  0.00  0.00    +0.081 A 
ATOM     30  C   LIG    1        5.352   3.354  -1.408  0.00  0.00    +0.069 C 
ATOM     31  N   LIG    1        6.527   2.416   0.520  0.00  0.00    -0.175 NA
ATOM     32  N   LIG    1        6.295   1.414   1.389  0.00  0.00    -0.272 N 
ATOM     33  C   LIG    1        7.252   1.147   2.434  0.00  0.00    +0.172 C 
ATOM     34  C   LIG    1        5.130   0.749   1.160  0.00  0.00    +0.131 A 
ENDBRANCH  26  28
ENDBRANCH   5  26
TORSDOF 4