REMARK  Name = BDB051357
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -3.339   3.320   0.048  0.00  0.00    -0.273 OA
ATOM      2  C   LIG    1       -2.842   2.199   0.160  0.00  0.00    +0.238 C 
ATOM      3  C   LIG    1       -3.526   1.045   0.911  0.00  0.00    +0.160 C 
ATOM      4  N   LIG    1       -3.081  -0.313   0.514  0.00  0.00    -0.317 N 
ATOM      5  C   LIG    1       -4.125  -0.979  -0.277  0.00  0.00    +0.106 C 
ATOM      6  C   LIG    1       -5.171   0.103  -0.532  0.00  0.00    +0.021 C 
ATOM      7  C   LIG    1       -1.775  -0.437   0.038  0.00  0.00    +0.052 A 
ATOM      8  C   LIG    1       -1.014   0.679  -0.349  0.00  0.00    +0.055 A 
ATOM      9  C   LIG    1        0.287   0.534  -0.838  0.00  0.00    +0.030 A 
ATOM     10  C   LIG    1        0.873  -0.737  -0.934  0.00  0.00    -0.031 A 
ATOM     11  C   LIG    1        0.122  -1.854  -0.549  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1       -1.184  -1.703  -0.071  0.00  0.00    +0.025 A 
ATOM     13  C   LIG    1       -5.037   1.016   0.676  0.00  0.00    +0.033 C 
ATOM     14  N   LIG    1       -1.579   1.959  -0.313  0.00  0.00    -0.282 N 
ATOM     15  H   LIG    1       -1.088   2.744  -0.717  0.00  0.00    +0.155 HD
ENDROOT
BRANCH  10  16
ATOM     16  C   LIG    1        2.280  -0.897  -1.468  0.00  0.00    +0.119 C 
BRANCH  16  17
ATOM     17  N   LIG    1        3.265  -0.098  -0.733  0.00  0.00    -0.298 NA
ATOM     18  C   LIG    1        4.589  -0.156  -1.355  0.00  0.00    +0.085 C 
ATOM     19  C   LIG    1        5.498   0.406  -0.273  0.00  0.00    +0.017 C 
ATOM     20  C   LIG    1        4.780   0.113   1.039  0.00  0.00    +0.017 C 
ATOM     21  C   LIG    1        3.476  -0.564   0.640  0.00  0.00    +0.085 C 
ENDBRANCH  16  17
ENDBRANCH  10  16
TORSDOF 2