REMARK  Name = BDB008144
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.328  -0.266  -0.017  0.00  0.00    +0.159 C 
ENDROOT
BRANCH   1   3
ATOM      2  C   LIG    1        2.119  -0.385  -0.293  0.00  0.00    +0.234 C 
ATOM      3  N   LIG    1        0.934   0.294  -0.489  0.00  0.00    -0.302 N 
ATOM      4  H   LIG    1        0.868   0.859  -1.329  0.00  0.00    +0.150 HD
ATOM      5  O   LIG    1        2.215  -1.374   0.434  0.00  0.00    -0.274 OA
BRANCH   2   6
ATOM      6  C   LIG    1        3.310   0.160  -1.105  0.00  0.00    +0.156 C 
ATOM      7  C   LIG    1        3.234  -0.352  -2.537  0.00  0.00    +0.038 C 
BRANCH   6  10
ATOM      8  C   LIG    1        6.270  -0.184   1.222  0.00  0.00    +0.109 C 
ATOM      9  C   LIG    1        5.177   0.509   0.454  0.00  0.00    +0.211 C 
ATOM     10  N   LIG    1        4.541  -0.294  -0.466  0.00  0.00    -0.304 N 
ATOM     11  H   LIG    1        4.573  -1.290  -0.275  0.00  0.00    +0.149 HD
ATOM     12  O   LIG    1        4.890   1.686   0.646  0.00  0.00    -0.276 OA
ENDBRANCH   6  10
ENDBRANCH   2   6
ENDBRANCH   1   3
BRANCH   1  13
ATOM     13  C   LIG    1       -0.952  -1.050  -1.191  0.00  0.00    +0.234 C 
ATOM     14  N   LIG    1       -1.906  -1.976  -0.822  0.00  0.00    -0.303 N 
ATOM     15  H   LIG    1       -2.330  -1.849   0.091  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1       -0.647  -0.834  -2.365  0.00  0.00    -0.274 OA
BRANCH  14  17
ATOM     17  C   LIG    1       -2.774  -2.572  -1.830  0.00  0.00    +0.156 C 
ATOM     18  C   LIG    1       -3.187  -3.979  -1.422  0.00  0.00    +0.038 C 
BRANCH  17  19
ATOM     19  C   LIG    1       -4.019  -1.679  -1.972  0.00  0.00    +0.231 C 
ATOM     20  O   LIG    1       -4.380  -0.876  -1.113  0.00  0.00    -0.274 OA
ATOM     21  N   LIG    1       -4.764  -1.869  -3.102  0.00  0.00    -0.328 N 
ATOM     22  H   LIG    1       -5.526  -1.217  -3.240  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1       -4.345  -2.262  -3.935  0.00  0.00    +0.145 HD
ENDBRANCH  17  19
ENDBRANCH  14  17
ENDBRANCH   1  13
BRANCH   1  24
ATOM     24  C   LIG    1       -1.290   0.841   0.435  0.00  0.00    +0.032 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -0.788   1.569   1.686  0.00  0.00    +0.003 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -1.784   2.639   2.141  0.00  0.00    +0.015 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -1.288   3.361   3.393  0.00  0.00    +0.077 C 
BRANCH  27  28
ATOM     28  N   LIG    1       -2.242   4.376   3.824  0.00  0.00    -0.330 NA
ATOM     29  H   LIG    1       -3.151   3.944   3.989  0.00  0.00    +0.118 HD
ATOM     30  H   LIG    1       -2.386   5.050   3.072  0.00  0.00    +0.118 HD
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH   1  24
TORSDOF 11