REMARK  Name = BDB052426
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.533   0.222   0.930  0.00  0.00    -0.259 N 
ATOM      2  C   LIG    1       -1.524  -0.183  -0.377  0.00  0.00    +0.092 A 
ATOM      3  C   LIG    1       -0.443  -0.642  -1.238  0.00  0.00    +0.097 A 
ATOM      4  C   LIG    1       -0.798  -1.233  -2.442  0.00  0.00    -0.001 A 
ATOM      5  C   LIG    1       -2.239  -1.458  -2.825  0.00  0.00    +0.043 C 
ATOM      6  C   LIG    1       -3.216  -0.426  -2.213  0.00  0.00    +0.044 C 
ATOM      7  C   LIG    1        0.259  -1.667  -3.199  0.00  0.00    +0.120 A 
ATOM      8  N   LIG    1        1.544  -1.508  -2.831  0.00  0.00    -0.222 NA
ATOM      9  C   LIG    1        1.788  -0.880  -1.665  0.00  0.00    +0.220 A 
ATOM     10  N   LIG    1        0.822  -0.439  -0.845  0.00  0.00    -0.212 NA
ATOM     11  C   LIG    1       -2.839  -0.095  -0.808  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -3.576   0.422   0.290  0.00  0.00    +0.151 A 
ATOM     13  N   LIG    1       -2.763   0.609   1.343  0.00  0.00    -0.165 NA
ENDROOT
BRANCH  12  14
ATOM     14  C   LIG    1       -5.010   0.739   0.376  0.00  0.00    +0.262 C 
ATOM     15  O   LIG    1       -5.484   1.693   0.985  0.00  0.00    -0.269 OA
ATOM     16  N   LIG    1       -5.848  -0.151  -0.248  0.00  0.00    -0.324 N 
ATOM     17  H   LIG    1       -5.528  -1.098  -0.386  0.00  0.00    +0.145 HD
ATOM     18  H   LIG    1       -6.823  -0.028  -0.005  0.00  0.00    +0.145 HD
ENDBRANCH  12  14
BRANCH   1  20
ATOM     19  C   LIG    1       -0.048   1.718   2.202  0.00  0.00    +0.032 C 
ATOM     20  C   LIG    1       -0.436   0.272   1.895  0.00  0.00    +0.102 C 
ATOM     21  C   LIG    1       -0.773  -0.491   3.180  0.00  0.00    +0.032 C 
ENDBRANCH   1  20
BRANCH   9  22
ATOM     22  N   LIG    1        3.136  -0.764  -1.340  0.00  0.00    -0.284 N 
ATOM     23  H   LIG    1        3.688  -1.213  -2.057  0.00  0.00    +0.155 HD
BRANCH  22  24
ATOM     24  C   LIG    1        3.837   0.002  -0.404  0.00  0.00    +0.034 A 
ATOM     25  C   LIG    1        3.252   1.012   0.364  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        3.989   1.716   1.322  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        5.329   1.408   1.537  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        5.929   0.396   0.795  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        5.186  -0.302  -0.162  0.00  0.00    +0.023 A 
ENDBRANCH  22  24
ENDBRANCH   9  22
TORSDOF 4