REMARK  Name = BDB033995
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.225  -1.246   0.432  0.00  0.00    +0.096 C 
ENDROOT
BRANCH   1   3
ATOM      2  C   LIG    1       -0.135  -3.438   0.909  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -0.318  -2.107   1.214  0.00  0.00    -0.311 N 
ATOM      4  H   LIG    1        0.388  -1.647   1.776  0.00  0.00    +0.149 HD
ATOM      5  O   LIG    1       -0.730  -4.008   0.003  0.00  0.00    -0.276 OA
BRANCH   2   7
ATOM      6  C   LIG    1        1.066  -5.581   1.478  0.00  0.00    +0.013 C 
ATOM      7  C   LIG    1        0.893  -4.107   1.800  0.00  0.00    +0.092 C 
ENDBRANCH   2   7
ENDBRANCH   1   3
BRANCH   1   8
ATOM      8  C   LIG    1       -1.562   0.024   1.236  0.00  0.00    +0.086 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -2.594   0.883   0.570  0.00  0.00    +0.081 A 
ATOM     10  S   LIG    1       -2.508   2.592   0.700  0.00  0.00    -0.072 S 
ATOM     11  C   LIG    1       -3.929   2.740  -0.259  0.00  0.00    +0.041 A 
ATOM     12  C   LIG    1       -4.379   1.463  -0.601  0.00  0.00    +0.079 A 
ATOM     13  C   LIG    1       -5.542   1.340  -1.388  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1       -6.220   2.489  -1.811  0.00  0.00    +0.022 A 
ATOM     15  C   LIG    1       -5.748   3.748  -1.456  0.00  0.00    +0.042 A 
ATOM     16 CL   LIG    1       -6.598   5.150  -1.986  0.00  0.00    -0.084 Cl
ATOM     17  C   LIG    1       -4.599   3.902  -0.676  0.00  0.00    +0.037 A 
ATOM     18  N   LIG    1       -3.614   0.416  -0.117  0.00  0.00    -0.244 NA
ENDBRANCH   8   9
ENDBRANCH   1   8
BRANCH   1  19
ATOM     19  C   LIG    1       -0.680  -0.975  -0.996  0.00  0.00    +0.128 C 
BRANCH  19  20
ATOM     20  N   LIG    1        0.771  -0.871  -1.082  0.00  0.00    -0.297 N 
ATOM     21  H   LIG    1        1.270  -1.748  -1.058  0.00  0.00    +0.150 HD
ATOM     22  C   LIG    1        1.453   0.263  -0.708  0.00  0.00    +0.304 C 
ATOM     23  N   LIG    1        2.810   0.085  -0.850  0.00  0.00    -0.269 N 
ATOM     24  H   LIG    1        3.082  -0.699  -1.422  0.00  0.00    +0.156 HD
ATOM     25  O   LIG    1        0.880   1.265  -0.304  0.00  0.00    -0.253 OA
BRANCH  23  26
ATOM     26  C   LIG    1        3.838   0.973  -0.474  0.00  0.00    +0.035 A 
ATOM     27  C   LIG    1        3.628   2.137   0.267  0.00  0.00    +0.023 A 
ATOM     28  C   LIG    1        4.705   2.961   0.612  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        5.999   2.625   0.222  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.219   1.464  -0.513  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1        5.144   0.641  -0.858  0.00  0.00    +0.023 A 
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 7