REMARK  Name = BDB034348
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.099   2.153  -0.010  0.00  0.00    -0.343 N 
ATOM      2  H   LIG    1        0.598   2.800  -0.616  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1        4.815   0.159  -0.487  0.00  0.00    -0.042 A 
ATOM      4  C   LIG    1        3.876  -0.885  -0.511  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1        2.508  -0.668  -0.391  0.00  0.00    +0.073 A 
ATOM      6  C   LIG    1        2.027   0.655  -0.257  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1        0.617   0.850  -0.158  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -0.193  -0.285  -0.114  0.00  0.00    +0.043 A 
ATOM      9  C   LIG    1        0.384  -1.533  -0.248  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1        2.975   1.706  -0.219  0.00  0.00    +0.012 A 
ATOM     11  N   LIG    1        1.704  -1.741  -0.400  0.00  0.00    -0.255 NA
ATOM     12  C   LIG    1        4.345   1.463  -0.335  0.00  0.00    +0.004 A 
BRANCH   3  13
ATOM     13  C   LIG    1        6.300  -0.154  -0.615  0.00  0.00    +0.019 C 
BRANCH  13  15
ATOM     14  C   LIG    1        6.648  -0.426   1.910  0.00  0.00    +0.004 C 
ATOM     15  C   LIG    1        7.097   0.280   0.635  0.00  0.00    +0.005 C 
ENDBRANCH  13  15
BRANCH  13  16
ATOM     16  C   LIG    1        6.855   0.480  -1.911  0.00  0.00    +0.005 C 
ATOM     17  C   LIG    1        8.250  -0.008  -2.280  0.00  0.00    +0.004 C 
ENDBRANCH  13  16
ENDBRANCH   3  13
ENDBRANCH   1   7
BRANCH   1  18
ATOM     18  C   LIG    1       -1.341   2.415  -0.009  0.00  0.00    +0.103 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.904   2.303   1.409  0.00  0.00    +0.034 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.405   2.596   1.468  0.00  0.00    +0.083 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -4.217   1.696   0.646  0.00  0.00    -0.312 NA
ATOM     22  H   LIG    1       -5.162   2.079   0.575  0.00  0.00    +0.122 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -4.348   0.360   1.251  0.00  0.00    +0.120 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -5.150  -0.577   0.377  0.00  0.00    +0.011 A 
ATOM     25  C   LIG    1       -6.076  -1.472   0.924  0.00  0.00    +0.163 A 
ATOM     26  C   LIG    1       -6.796  -2.378   0.127  0.00  0.00    +0.162 A 
ATOM     27  C   LIG    1       -6.576  -2.396  -1.248  0.00  0.00    +0.049 A 
ATOM     28  C   LIG    1       -5.641  -1.526  -1.813  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -4.931  -0.631  -1.009  0.00  0.00    +0.009 A 
BRANCH  25  30
ATOM     30  O   LIG    1       -6.289  -1.478   2.280  0.00  0.00    -0.503 OA
ATOM     31  H   LIG    1       -6.960  -2.174   2.425  0.00  0.00    +0.292 HD
ENDBRANCH  25  30
BRANCH  26  32
ATOM     32  O   LIG    1       -7.670  -3.182   0.816  0.00  0.00    -0.491 OA
ATOM     33  C   LIG    1       -8.405  -4.128   0.048  0.00  0.00    +0.277 C 
ENDBRANCH  26  32
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 12