REMARK  Name = BDB015052
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.693   0.041   1.137  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.949  -0.405   1.442  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1        3.097  -0.226   0.665  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        4.342  -0.735   1.083  0.00  0.00    -0.014 A 
ATOM      5  C   LIG    1        4.406  -1.431   2.300  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        3.265  -1.608   3.081  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        2.043  -1.094   2.652  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1        5.549  -0.536   0.264  0.00  0.00    -0.016 A 
ATOM      9  C   LIG    1        5.987   0.768  -0.046  0.00  0.00    +0.038 A 
ATOM     10  C   LIG    1        7.140   0.890  -0.826  0.00  0.00    +0.086 A 
ATOM     11  C   LIG    1        7.860  -0.195  -1.304  0.00  0.00    +0.112 A 
ATOM     12  N   LIG    1        8.930   0.252  -2.033  0.00  0.00    -0.130 NA
ATOM     13  N   LIG    1        8.907   1.579  -2.027  0.00  0.00    -0.067 NA
ATOM     14  C   LIG    1        7.430  -1.491  -1.000  0.00  0.00    +0.032 A 
ATOM     15  N   LIG    1        7.842   1.960  -1.304  0.00  0.00    -0.257 N 
ATOM     16  H   LIG    1        7.662   2.949  -1.183  0.00  0.00    +0.191 HD
ATOM     17  C   LIG    1        6.276  -1.644  -0.215  0.00  0.00    +0.011 A 
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1        0.513   0.682  -0.130  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -0.958   1.079  -0.326  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -1.281   2.199   0.512  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -2.254   2.155   0.619  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -1.937  -0.074  -0.017  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.348   0.375  -0.115  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -4.223  -0.590   0.589  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -5.701  -0.310   0.420  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -6.171   0.471  -0.650  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -7.546   0.690  -0.802  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -8.453   0.116   0.087  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -7.993  -0.676   1.137  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.190   1.123  -1.589  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -6.625  -0.890   1.302  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -3.793   0.492  -1.515  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 7