REMARK  Name = BDB042510
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        4.070  -0.630  -0.998  0.00  0.00    -0.312 N 
ATOM      2  C   LIG    1        3.371   0.226  -1.978  0.00  0.00    +0.125 C 
ATOM      3  C   LIG    1        1.850   0.292  -1.726  0.00  0.00    +0.126 C 
ATOM      4  N   LIG    1        1.236  -1.033  -1.530  0.00  0.00    -0.298 N 
ATOM      5  C   LIG    1       -0.128  -1.268  -1.672  0.00  0.00    +0.216 C 
ATOM      6  O   LIG    1       -0.657  -2.302  -1.259  0.00  0.00    -0.276 OA
ATOM      7  C   LIG    1        1.975  -1.937  -0.636  0.00  0.00    +0.126 C 
ATOM      8  C   LIG    1        3.484  -1.986  -0.937  0.00  0.00    +0.125 C 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1        4.886   1.198   2.673  0.00  0.00    +0.070 A 
ATOM     10  C   LIG    1        4.109   1.784   1.692  0.00  0.00    +0.131 A 
ATOM     11  N   LIG    1        3.833   1.206   0.496  0.00  0.00    -0.239 NA
ATOM     12  C   LIG    1        4.330  -0.024   0.238  0.00  0.00    +0.121 A 
ATOM     13  C   LIG    1        5.140  -0.666   1.179  0.00  0.00    +0.045 A 
ATOM     14  C   LIG    1        5.417  -0.057   2.405  0.00  0.00    +0.024 A 
BRANCH   9  16
ATOM     15  N   LIG    1        5.346   2.424   4.905  0.00  0.00    -0.191 NA
ATOM     16  C   LIG    1        5.139   1.872   3.906  0.00  0.00    +0.101 C 
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   5  17
ATOM     17  C   LIG    1       -0.943  -0.200  -2.388  0.00  0.00    +0.102 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -2.439  -0.526  -2.459  0.00  0.00    +0.062 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.170  -0.268  -1.160  0.00  0.00    +0.020 A 
ATOM     20  N   LIG    1       -2.921  -1.135  -0.121  0.00  0.00    -0.326 N 
ATOM     21  H   LIG    1       -2.253  -1.898  -0.257  0.00  0.00    +0.169 HD
ATOM     22  C   LIG    1       -3.491  -1.065   1.134  0.00  0.00    +0.259 A 
ATOM     23  O   LIG    1       -3.199  -1.870   2.010  0.00  0.00    -0.267 OA
ATOM     24  C   LIG    1       -4.460   0.036   1.347  0.00  0.00    +0.082 A 
ATOM     25  C   LIG    1       -4.724   0.917   0.284  0.00  0.00    -0.008 A 
ATOM     26  C   LIG    1       -5.638   1.964   0.465  0.00  0.00    +0.009 A 
ATOM     27  C   LIG    1       -6.282   2.131   1.693  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1       -6.015   1.255   2.744  0.00  0.00    +0.039 A 
ATOM     29  C   LIG    1       -5.107   0.212   2.569  0.00  0.00    +0.136 A 
ATOM     30  F   LIG    1       -4.884  -0.604   3.608  0.00  0.00    -0.205 F 
ATOM     31  C   LIG    1       -4.045   0.737  -1.002  0.00  0.00    +0.030 A 
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   5  17
TORSDOF 5