REMARK  Name = BDB016133
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.231  -0.063   2.972  0.00  0.00    +0.028 C 
ATOM      2  C   LIG    1       -2.655   0.416   1.580  0.00  0.00    +0.076 C 
ATOM      3  N   LIG    1       -1.666  -0.053   0.621  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1       -0.722  -0.026   1.006  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1       -1.657   0.477  -0.688  0.00  0.00    +0.056 A 
ATOM      6  C   LIG    1       -2.768   1.057  -1.345  0.00  0.00    +0.055 A 
ATOM      7  C   LIG    1       -2.610   1.569  -2.651  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1       -1.407   1.465  -3.342  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -0.332   0.830  -2.743  0.00  0.00    +0.010 A 
ATOM     10  N   LIG    1       -4.079   1.204  -0.845  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -4.731   1.721  -1.423  0.00  0.00    +0.155 HD
ATOM     12  C   LIG    1       -4.705   0.726   0.258  0.00  0.00    +0.219 C 
ATOM     13  O   LIG    1       -5.895   1.012   0.424  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -0.448   0.330  -1.437  0.00  0.00    -0.002 A 
ATOM     15  C   LIG    1       -4.000  -0.173   1.220  0.00  0.00    +0.118 C 
ENDROOT
BRANCH  14  16
ATOM     16  C   LIG    1        0.722  -0.373  -0.875  0.00  0.00    +0.010 C 
ATOM     17  C   LIG    1        1.879   0.255  -0.613  0.00  0.00    +0.008 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.068  -0.399  -0.045  0.00  0.00    -0.025 A 
ATOM     19  C   LIG    1        2.984  -1.471   0.853  0.00  0.00    +0.009 A 
ATOM     20  C   LIG    1        4.142  -2.044   1.391  0.00  0.00    +0.019 A 
ATOM     21  C   LIG    1        5.399  -1.544   1.045  0.00  0.00    +0.052 A 
ATOM     22  C   LIG    1        5.493  -0.465   0.162  0.00  0.00    +0.019 A 
ATOM     23  C   LIG    1        4.334   0.105  -0.375  0.00  0.00    +0.009 A 
BRANCH  21  24
ATOM     24  C   LIG    1        6.586  -2.130   1.596  0.00  0.00    +0.099 C 
ATOM     25  N   LIG    1        7.547  -2.603   2.043  0.00  0.00    -0.191 NA
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH  14  16
TORSDOF 3