REMARK  Name = BDB015128
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.210  -0.714   0.034  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        3.014   0.005  -0.082  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        1.775  -0.612   0.124  0.00  0.00    +0.122 A 
ATOM      4  C   LIG    1        1.728  -1.974   0.406  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.914  -2.700   0.520  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        4.150  -2.073   0.340  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        7.039  -1.584   0.375  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        6.703  -0.483  -0.044  0.00  0.00    +0.250 C 
ATOM      9  N   LIG    1        5.412  -0.007  -0.186  0.00  0.00    -0.281 N 
ATOM     10  H   LIG    1        5.300   0.974  -0.407  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1        7.772   0.478  -0.410  0.00  0.00    +0.055 A 
ATOM     12  C   LIG    1        8.986   0.417   0.264  0.00  0.00    +0.123 A 
ATOM     13  N   LIG    1       10.029   1.250   0.018  0.00  0.00    -0.263 NA
ATOM     14  C   LIG    1        9.858   2.166  -0.959  0.00  0.00    +0.111 A 
ATOM     15  C   LIG    1        8.694   2.291  -1.702  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        7.634   1.430  -1.425  0.00  0.00    +0.016 A 
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   3  17
ATOM     17  O   LIG    1        0.686   0.198  -0.033  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -0.470  -0.093   0.766  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.631  -0.558  -0.122  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -1.464  -1.940  -0.477  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -2.356  -2.235  -0.755  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.981  -0.416   0.617  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -4.103  -0.984  -0.169  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -5.312  -1.135   0.668  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -6.268   0.031   0.607  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -6.558   0.568  -0.659  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -7.501   1.587  -0.794  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -8.144   2.085   0.340  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -7.854   1.559   1.601  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.811  -0.019  -1.826  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -6.923   0.528   1.736  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -4.340  -0.214  -1.417  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 8