REMARK  Name = BDB015242
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.067   1.040  -1.413  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   4
ATOM      2  C   LIG    1        3.311  -0.610  -1.267  0.00  0.00    -0.014 A 
ATOM      3  C   LIG    1        2.128   0.070  -0.932  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        1.161   0.376  -1.896  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1        1.375   0.005  -3.221  0.00  0.00    +0.045 A 
ATOM      6  C   LIG    1        2.543  -0.672  -3.576  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1        3.501  -0.977  -2.608  0.00  0.00    +0.009 A 
BRANCH   2  14
ATOM      8  C   LIG    1        6.480   1.896   2.635  0.00  0.00    +0.150 C 
ATOM      9  N   LIG    1        6.550   0.472   2.431  0.00  0.00    -0.333 N 
ATOM     10  C   LIG    1        5.828  -0.251   1.514  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1        6.254  -1.561   1.710  0.00  0.00    +0.089 A 
ATOM     12  C   LIG    1        5.711  -2.583   0.921  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1        4.751  -2.251  -0.047  0.00  0.00    +0.011 A 
ATOM     14  C   LIG    1        4.321  -0.926  -0.242  0.00  0.00    -0.016 A 
ATOM     15  N   LIG    1        7.195  -1.631   2.708  0.00  0.00    -0.236 NA
ATOM     16  C   LIG    1        4.869   0.100   0.555  0.00  0.00    +0.036 A 
ATOM     17  C   LIG    1        7.351  -0.393   3.120  0.00  0.00    +0.200 A 
ENDBRANCH   2  14
ENDBRANCH   1   4
BRANCH   1  18
ATOM     18  C   LIG    1       -1.010   1.277  -2.331  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.160   1.949  -1.566  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -1.684   3.184  -1.006  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -0.830   2.976  -0.582  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.727   1.074  -0.424  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.251  -0.240  -0.849  0.00  0.00    -0.290 NA
ATOM     24  C   LIG    1       -4.496  -0.144  -1.653  0.00  0.00    +0.165 C 
ATOM     25  C   LIG    1       -5.752   0.406  -0.932  0.00  0.00    +0.287 C 
ATOM     26  F   LIG    1       -5.703   1.771  -0.978  0.00  0.00    -0.199 F 
ATOM     27  F   LIG    1       -6.844   0.064  -1.680  0.00  0.00    -0.199 F 
ATOM     28  C   LIG    1       -5.852  -0.102   0.489  0.00  0.00    +0.026 A 
ATOM     29  C   LIG    1       -4.772  -0.780   1.093  0.00  0.00    -0.025 A 
ATOM     30  C   LIG    1       -4.897  -1.221   2.420  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1       -6.063  -0.973   3.144  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -7.122  -0.289   2.551  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -7.018   0.146   1.231  0.00  0.00    +0.010 A 
ATOM     34  C   LIG    1       -3.513  -1.110   0.316  0.00  0.00    +0.120 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 7