REMARK  Name = BDB011662
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.107  -1.255  -0.103  0.00  0.00    +0.270 C 
ATOM      2  N   LIG    1       -0.972  -0.431   0.132  0.00  0.00    -0.274 N 
ATOM      3  H   LIG    1       -0.746   0.462   0.573  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1        0.041  -2.421  -0.475  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -2.308  -0.676  -0.009  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1       -3.293   0.270   0.597  0.00  0.00    +0.289 A 
ATOM      7  O   LIG    1       -2.975   1.327   1.121  0.00  0.00    -0.264 OA
ATOM      8  N   LIG    1       -4.569  -0.260   0.398  0.00  0.00    -0.245 N 
ATOM      9  N   LIG    1       -4.433  -1.404  -0.445  0.00  0.00    -0.287 N 
ATOM     10  C   LIG    1       -5.314  -2.528  -0.115  0.00  0.00    +0.170 C 
ATOM     11  C   LIG    1       -3.052  -1.609  -0.626  0.00  0.00    +0.059 A 
ATOM     12  C   LIG    1       -2.586  -2.719  -1.514  0.00  0.00    +0.067 C 
BRANCH   8  13
ATOM     13  C   LIG    1       -5.721   0.633   0.272  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1       -6.890   0.202   1.169  0.00  0.00    +0.027 C 
ATOM     15  C   LIG    1       -8.059   1.180   1.069  0.00  0.00    +0.002 C 
ATOM     16  C   LIG    1       -8.504   1.379  -0.377  0.00  0.00    +0.000 C 
ATOM     17  C   LIG    1       -7.345   1.818  -1.268  0.00  0.00    +0.002 C 
ATOM     18  C   LIG    1       -6.169   0.847  -1.183  0.00  0.00    +0.027 C 
ENDBRANCH   8  13
ENDBRANCH   2   5
BRANCH   1  24
ATOM     19  C   LIG    1        3.106  -2.530  -0.295  0.00  0.00    +0.050 C 
ATOM     20  C   LIG    1        2.716  -1.152   0.088  0.00  0.00    +0.026 A 
ATOM     21  C   LIG    1        3.542  -0.096   0.423  0.00  0.00    +0.169 A 
ATOM     22  O   LIG    1        2.777   0.983   0.742  0.00  0.00    -0.356 OA
ATOM     23  N   LIG    1        1.445   0.678   0.584  0.00  0.00    -0.073 NA
ATOM     24  C   LIG    1        1.398  -0.604   0.179  0.00  0.00    +0.171 A 
BRANCH  21  25
ATOM     25  C   LIG    1        5.011   0.103   0.539  0.00  0.00    +0.187 C 
ATOM     26  O   LIG    1        5.678  -0.867  -0.294  0.00  0.00    -0.368 OA
ATOM     27  C   LIG    1        6.612  -0.177  -1.138  0.00  0.00    +0.164 C 
ATOM     28  C   LIG    1        6.885   1.172  -0.480  0.00  0.00    +0.020 C 
ATOM     29  C   LIG    1        5.492   1.467   0.059  0.00  0.00    +0.045 C 
BRANCH  28  30
ATOM     30  C   LIG    1        7.989   1.103   0.611  0.00  0.00    -0.012 C 
ATOM     31  C   LIG    1        9.363   0.806  -0.008  0.00  0.00    +0.007 C 
ATOM     32  C   LIG    1        8.092   2.409   1.408  0.00  0.00    +0.007 C 
ENDBRANCH  28  30
ENDBRANCH  21  25
ENDBRANCH   1  24
TORSDOF 5