REMARK  Name = BDB032761
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.828  -0.355   0.114  0.00  0.00    -0.282 N 
ATOM      2  C   LIG    1       -3.784   0.455  -0.310  0.00  0.00    +0.248 C 
ATOM      3  O   LIG    1       -3.715   1.115  -1.329  0.00  0.00    -0.270 OA
ATOM      4  C   LIG    1       -2.740   0.373   0.717  0.00  0.00    +0.042 A 
ATOM      5  C   LIG    1       -3.214  -0.426   1.755  0.00  0.00    -0.018 A 
ATOM      6  C   LIG    1       -2.420  -0.675   2.859  0.00  0.00    +0.006 A 
ATOM      7  C   LIG    1       -1.142  -0.103   2.896  0.00  0.00    +0.007 A 
ATOM      8  C   LIG    1       -0.669   0.718   1.845  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -1.486   0.953   0.729  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -4.603  -0.883   1.454  0.00  0.00    +0.144 C 
ENDROOT
BRANCH   1  17
ATOM     11  O   LIG    1      -10.228  -0.780  -0.698  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -9.012  -0.616  -0.740  0.00  0.00    +0.219 C 
ATOM     13  N   LIG    1       -8.431   0.510  -0.216  0.00  0.00    -0.255 N 
ATOM     14  H   LIG    1       -9.070   1.127   0.269  0.00  0.00    +0.158 HD
ATOM     15  C   LIG    1       -7.116   0.625   0.176  0.00  0.00    +0.240 C 
ATOM     16  O   LIG    1       -6.796   1.439   1.039  0.00  0.00    -0.273 OA
ATOM     17  C   LIG    1       -6.136  -0.328  -0.530  0.00  0.00    +0.163 C 
ATOM     18  C   LIG    1       -6.769  -1.713  -0.621  0.00  0.00    +0.041 C 
ATOM     19  C   LIG    1       -8.083  -1.620  -1.381  0.00  0.00    +0.098 C 
ENDBRANCH   1  17
BRANCH   8  20
ATOM     20  C   LIG    1        0.718   1.308   1.903  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1        1.573   0.481   1.109  0.00  0.00    -0.445 OA
BRANCH  21  22
ATOM     22  C   LIG    1        2.872   0.875   1.114  0.00  0.00    +0.405 C 
ATOM     23  N   LIG    1        3.576   0.021   0.315  0.00  0.00    -0.250 N 
ATOM     24  H   LIG    1        3.011  -0.700  -0.111  0.00  0.00    +0.158 HD
ATOM     25  O   LIG    1        3.296   1.833   1.739  0.00  0.00    -0.226 OA
BRANCH  23  26
ATOM     26  C   LIG    1        4.952   0.049   0.033  0.00  0.00    +0.055 A 
ATOM     27  C   LIG    1        5.855   0.972   0.544  0.00  0.00    +0.134 A 
ATOM     28  N   LIG    1        7.183   0.978   0.259  0.00  0.00    -0.258 NA
ATOM     29  C   LIG    1        7.670   0.033  -0.582  0.00  0.00    +0.044 A 
ATOM     30  C   LIG    1        6.824  -0.932  -1.130  0.00  0.00    +0.025 A 
ATOM     31  C   LIG    1        5.462  -0.923  -0.823  0.00  0.00    +0.027 A 
BRANCH  29  32
ATOM     32  C   LIG    1        9.147   0.032  -0.893  0.00  0.00    +0.038 C 
ATOM     33  C   LIG    1        9.627   0.290  -2.304  0.00  0.00    +0.010 C 
ATOM     34  C   LIG    1        9.843   1.328  -1.244  0.00  0.00    +0.010 C 
ENDBRANCH  29  32
ENDBRANCH  23  26
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   8  20
TORSDOF 6