REMARK  Name = BDB032247
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.405  -0.306  -0.134  0.00  0.00    +0.121 A 
ATOM      2  N   LIG    1       -1.289  -1.651  -0.147  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.140  -2.203  -0.602  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1        0.959  -1.486  -1.058  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1        0.831  -0.101  -1.044  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.347   0.487  -0.573  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1       -4.763   0.359   1.156  0.00  0.00    +0.039 C 
ATOM      8  C   LIG    1       -3.669  -0.637   0.742  0.00  0.00    +0.112 C 
ATOM      9  N   LIG    1       -2.569   0.243   0.350  0.00  0.00    -0.315 N 
ATOM     10  C   LIG    1       -3.042   1.573  -0.006  0.00  0.00    +0.107 C 
ATOM     11  C   LIG    1       -4.564   1.485   0.139  0.00  0.00    +0.027 C 
BRANCH   7  13
ATOM     12  C   LIG    1       -6.716  -0.868  -0.017  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -6.184  -0.226   1.268  0.00  0.00    +0.065 C 
ATOM     14  C   LIG    1       -7.176   0.846   1.741  0.00  0.00    +0.041 C 
BRANCH  13  15
ATOM     15  O   LIG    1       -6.166  -1.260   2.260  0.00  0.00    -0.389 OA
ATOM     16  H   LIG    1       -5.903  -0.864   3.109  0.00  0.00    +0.210 HD
ENDBRANCH  13  15
ENDBRANCH   7  13
ENDBRANCH   1   9
BRANCH   4  17
ATOM     17  C   LIG    1        2.162  -2.239  -1.562  0.00  0.00    +0.138 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.359  -1.429  -1.758  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1        3.240  -0.747  -2.499  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1        4.146  -0.943  -0.701  0.00  0.00    +0.035 A 
ATOM     21  C   LIG    1        5.273  -0.104  -0.982  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        6.077   0.381   0.080  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1        7.170   1.219  -0.237  0.00  0.00    +0.124 A 
ATOM     24  N   LIG    1        7.493   1.594  -1.487  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1        6.731   1.110  -2.482  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1        5.762   0.010   1.402  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1        4.703  -0.847   1.672  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1        5.645   0.275  -2.287  0.00  0.00    +0.030 A 
ATOM     29  C   LIG    1        3.918  -1.330   0.628  0.00  0.00    +0.023 A 
BRANCH  23  30
ATOM     30  N   LIG    1        8.022   1.731   0.750  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1        8.436   0.976   1.283  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1        8.732   2.263   0.252  0.00  0.00    +0.144 HD
ENDBRANCH  23  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 7