REMARK  Name = BDB018813
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.363   0.035   0.873  0.00  0.00    -0.013 A 
ATOM      2  C   LIG    1        1.119   0.013   0.237  0.00  0.00    -0.017 A 
ATOM      3  C   LIG    1        0.820   0.349  -1.192  0.00  0.00    +0.057 C 
ATOM      4  C   LIG    1       -0.663  -0.015  -1.305  0.00  0.00    +0.118 C 
ATOM      5  N   LIG    1       -1.163  -0.278   0.055  0.00  0.00    -0.269 N 
ATOM      6  C   LIG    1       -2.478  -0.557   0.407  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1       -2.840  -0.826   1.556  0.00  0.00    -0.273 OA
ATOM      8  C   LIG    1       -0.053  -0.321   0.925  0.00  0.00    +0.040 A 
ATOM      9  C   LIG    1       -0.015  -0.641   2.272  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1        1.217  -0.632   2.927  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1        2.392  -0.301   2.236  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     12  C   LIG    1        5.704  -0.265  -0.868  0.00  0.00    +0.052 A 
ATOM     13  C   LIG    1        4.525  -0.602  -0.192  0.00  0.00    +0.027 A 
ATOM     14  C   LIG    1        3.597   0.389   0.167  0.00  0.00    -0.016 A 
ATOM     15  C   LIG    1        3.879   1.724  -0.162  0.00  0.00    +0.008 A 
ATOM     16  C   LIG    1        5.054   2.064  -0.835  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1        5.966   1.070  -1.189  0.00  0.00    +0.019 A 
BRANCH  12  19
ATOM     18  N   LIG    1        7.399  -2.115  -1.529  0.00  0.00    -0.191 NA
ATOM     19  C   LIG    1        6.640  -1.288  -1.231  0.00  0.00    +0.099 C 
ENDBRANCH  12  19
ENDBRANCH   1  14
BRANCH   6  20
ATOM     20  C   LIG    1       -3.517  -0.452  -0.727  0.00  0.00    +0.170 C 
ATOM     21  N   LIG    1       -4.762  -1.240  -0.469  0.00  0.00    -0.258 N 
ATOM     22  C   LIG    1       -5.829  -0.319   0.002  0.00  0.00    +0.117 C 
ATOM     23  C   LIG    1       -5.166   1.045   0.130  0.00  0.00    +0.022 C 
ATOM     24  C   LIG    1       -4.020   0.985  -0.865  0.00  0.00    +0.034 C 
BRANCH  21  25
ATOM     25  C   LIG    1       -4.787  -2.569  -0.310  0.00  0.00    +0.170 C 
ATOM     26  N   LIG    1       -4.807  -3.721  -0.209  0.00  0.00    -0.174 NA
ENDBRANCH  21  25
ENDBRANCH   6  20
TORSDOF 4