REMARK  Name = BDB018903
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.067   1.457  -0.703  0.00  0.00    -0.017 A 
ATOM      2  C   LIG    1        0.245   1.309  -0.235  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1        1.332   1.140  -1.120  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        2.710   1.008  -0.526  0.00  0.00    +0.148 C 
ATOM      5  N   LIG    1        3.351  -0.261  -0.859  0.00  0.00    -0.278 N 
ATOM      6  C   LIG    1        3.485  -0.594  -2.278  0.00  0.00    +0.150 C 
ATOM      7  C   LIG    1        3.329   0.591  -3.230  0.00  0.00    +0.248 C 
ATOM      8  O   LIG    1        1.974   0.937  -3.511  0.00  0.00    -0.490 OA
ATOM      9  C   LIG    1        3.520  -1.314   0.027  0.00  0.00    +0.302 C 
ATOM     10  N   LIG    1        3.410  -0.987   1.355  0.00  0.00    -0.302 N 
ATOM     11  H   LIG    1        3.832  -0.104   1.595  0.00  0.00    +0.150 HD
ATOM     12  C   LIG    1        3.554  -2.022   2.350  0.00  0.00    +0.129 C 
ATOM     13  O   LIG    1        3.764  -2.460  -0.344  0.00  0.00    -0.253 OA
ATOM     14  C   LIG    1        1.077   1.117  -2.497  0.00  0.00    +0.125 A 
ATOM     15  C   LIG    1       -0.237   1.274  -2.961  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1       -1.303   1.439  -2.077  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  19
ATOM     17  C   LIG    1       -2.381  -0.761   0.898  0.00  0.00    +0.077 C 
ATOM     18  C   LIG    1       -2.812   0.514   0.993  0.00  0.00    +0.021 C 
ATOM     19  C   LIG    1       -2.185   1.619   0.251  0.00  0.00    -0.008 C 
ATOM     20  C   LIG    1       -2.619   2.881   0.431  0.00  0.00    +0.009 C 
ATOM     21  C   LIG    1       -3.692   3.204   1.337  0.00  0.00    +0.003 C 
ATOM     22  C   LIG    1       -4.349   2.268   2.030  0.00  0.00    +0.028 C 
ATOM     23  C   LIG    1       -3.993   0.827   1.894  0.00  0.00    +0.064 C 
ATOM     24  N   LIG    1       -4.689  -0.078   2.517  0.00  0.00    -0.299 NA
ATOM     25  H   LIG    1       -5.439   0.352   3.065  0.00  0.00    +0.187 HD
BRANCH  17  27
ATOM     26  C   LIG    1       -2.708  -3.230   1.068  0.00  0.00    +0.125 C 
ATOM     27  N   LIG    1       -2.842  -1.880   1.561  0.00  0.00    -0.352 N 
ATOM     28  H   LIG    1       -3.718  -1.673   2.066  0.00  0.00    +0.145 HD
ENDBRANCH  17  27
ENDBRANCH   1  19
TORSDOF 2