REMARK  Name = BDB051957
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.877  -0.559  -0.827  0.00  0.00    +0.062 A 
ATOM      2  C   LIG    1       -1.973  -0.485   0.085  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -3.127  -0.129  -0.644  0.00  0.00    +0.057 A 
ATOM      4  C   LIG    1       -4.356   0.046   0.029  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1       -4.427  -0.160   1.411  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1       -3.308  -0.543   2.129  0.00  0.00    +0.001 A 
ATOM      7  N   LIG    1       -2.758  -0.028  -1.995  0.00  0.00    -0.287 N 
ATOM      8  C   LIG    1       -3.517   0.282  -3.150  0.00  0.00    +0.229 C 
ATOM      9  O   LIG    1       -2.951   0.342  -4.238  0.00  0.00    -0.273 OA
ATOM     10  C   LIG    1       -4.978   0.526  -2.985  0.00  0.00    +0.113 C 
ATOM     11  C   LIG    1       -2.087  -0.712   1.479  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1       -1.402  -0.305  -2.073  0.00  0.00    +0.108 A 
ENDROOT
BRANCH   1  15
ATOM     13  N   LIG    1        1.024  -0.435   0.616  0.00  0.00    -0.310 N 
ATOM     14  H   LIG    1        0.462   0.204   1.161  0.00  0.00    +0.149 HD
ATOM     15  C   LIG    1        0.533  -0.857  -0.599  0.00  0.00    +0.246 C 
ATOM     16  O   LIG    1        1.241  -1.386  -1.451  0.00  0.00    -0.270 OA
BRANCH  13  17
ATOM     17  C   LIG    1        2.430  -0.555   0.944  0.00  0.00    +0.123 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.298   0.486   0.225  0.00  0.00    +0.123 C 
BRANCH  18  21
ATOM     19  C   LIG    1        6.677   0.557   1.945  0.00  0.00    +0.109 C 
ATOM     20  C   LIG    1        5.201   0.787   1.764  0.00  0.00    +0.210 C 
ATOM     21  N   LIG    1        4.706   0.365   0.554  0.00  0.00    -0.314 N 
ATOM     22  H   LIG    1        5.304  -0.141  -0.087  0.00  0.00    +0.149 HD
ATOM     23  O   LIG    1        4.505   1.291   2.640  0.00  0.00    -0.276 OA
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH  13  17
ENDBRANCH   1  15
TORSDOF 4