REMARK  Name = BDB015133
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.109  -1.795  -1.010  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   4
ATOM      2  C   LIG    1        3.419  -1.402   0.143  0.00  0.00    -0.014 A 
ATOM      3  C   LIG    1        2.169  -1.068  -0.413  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        1.138  -2.008  -0.489  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1        1.354  -3.300  -0.009  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1        2.583  -3.653   0.545  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        3.608  -2.709   0.620  0.00  0.00    +0.009 A 
BRANCH   2  12
ATOM      8  C   LIG    1        6.589   1.513   0.367  0.00  0.00    +0.138 A 
ATOM      9  C   LIG    1        5.328   1.776   0.924  0.00  0.00    +0.083 A 
ATOM     10 CL   LIG    1        4.990   3.276   1.720  0.00  0.00    -0.080 Cl
ATOM     11  C   LIG    1        4.299   0.830   0.853  0.00  0.00    +0.032 A 
ATOM     12  C   LIG    1        4.500  -0.406   0.223  0.00  0.00    -0.016 A 
ATOM     13  C   LIG    1        5.763  -0.663  -0.330  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1        6.795   0.282  -0.261  0.00  0.00    +0.048 A 
BRANCH   8  16
ATOM     15  C   LIG    1        8.819   2.247  -0.075  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1        7.535   2.497   0.482  0.00  0.00    -0.494 OA
ENDBRANCH   8  16
ENDBRANCH   2  12
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1       -0.416  -0.465  -1.450  0.00  0.00    +0.261 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -1.875  -0.435  -1.929  0.00  0.00    +0.166 C 
BRANCH  18  19
ATOM     19  O   LIG    1       -2.036  -1.388  -2.993  0.00  0.00    -0.387 OA
ATOM     20  H   LIG    1       -1.603  -2.208  -2.685  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1       -2.889  -0.764  -0.809  0.00  0.00    +0.119 C 
BRANCH  21  22
ATOM     22  N   LIG    1       -2.845   0.167   0.333  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1       -3.497   1.460   0.045  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1       -5.011   1.439   0.074  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1       -5.708   0.438   0.775  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -7.109   0.463   0.816  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -7.814   1.487   0.186  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -7.126   2.490  -0.493  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -4.956  -0.697   1.425  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1       -5.732   2.469  -0.546  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -3.451  -0.415   1.543  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8