REMARK  Name = BDB064194
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.891  -0.736  -0.087  0.00  0.00    +0.136 A 
ATOM      2  C   LIG    1       -0.488  -0.794   0.020  0.00  0.00    +0.041 A 
ATOM      3  C   LIG    1        0.185   0.412  -0.179  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        1.577   0.426  -0.099  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        2.358  -0.709   0.185  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        1.659  -1.901   0.392  0.00  0.00    +0.024 A 
ATOM      7  N   LIG    1       -0.451   1.559  -0.445  0.00  0.00    -0.227 NA
ATOM      8  C   LIG    1       -1.798   1.525  -0.502  0.00  0.00    +0.166 A 
ATOM      9  C   LIG    1        0.264  -1.952   0.318  0.00  0.00    +0.015 A 
ATOM     10  N   LIG    1       -2.530   0.416  -0.348  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   5  11
ATOM     11  N   LIG    1        3.739  -0.647   0.252  0.00  0.00    -0.327 N 
ATOM     12  C   LIG    1        4.582  -1.852   0.172  0.00  0.00    +0.120 C 
ATOM     13  C   LIG    1        5.999  -1.491  -0.329  0.00  0.00    +0.103 C 
ATOM     14  N   LIG    1        6.726  -0.544   0.544  0.00  0.00    -0.302 NA
ATOM     15  C   LIG    1        7.744   0.176  -0.216  0.00  0.00    +0.105 C 
ATOM     16  C   LIG    1        5.796   0.379   1.228  0.00  0.00    +0.103 C 
ATOM     17  C   LIG    1        4.442   0.622   0.519  0.00  0.00    +0.120 C 
ENDBRANCH   5  11
BRANCH   8  18
ATOM     18  C   LIG    1       -2.505   2.794  -0.772  0.00  0.00    +0.061 A 
ATOM     19  C   LIG    1       -1.840   4.007  -1.048  0.00  0.00    +0.128 A 
ATOM     20  C   LIG    1       -2.537   5.190  -1.305  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1       -3.928   5.198  -1.289  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1       -4.620   4.023  -1.016  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1       -3.916   2.840  -0.761  0.00  0.00    +0.015 A 
BRANCH  19  24
ATOM     24  O   LIG    1       -0.471   4.116  -1.086  0.00  0.00    -0.506 OA
ATOM     25  H   LIG    1       -0.108   3.234  -0.857  0.00  0.00    +0.292 HD
ENDBRANCH  19  24
ENDBRANCH   8  18
BRANCH   1  26
ATOM     26  N   LIG    1       -2.645  -1.928   0.061  0.00  0.00    -0.282 N 
ATOM     27  H   LIG    1       -2.261  -2.647  -0.537  0.00  0.00    +0.155 HD
BRANCH  26  33
ATOM     28  C   LIG    1       -7.224  -3.745   0.523  0.00  0.00    +0.065 C 
ATOM     29  C   LIG    1       -5.978  -2.950   0.554  0.00  0.00    +0.035 A 
ATOM     30  N   LIG    1       -5.897  -1.737   1.177  0.00  0.00    -0.280 N 
ATOM     31  H   LIG    1       -6.625  -1.236   1.674  0.00  0.00    +0.189 HD
ATOM     32  N   LIG    1       -4.684  -1.179   1.110  0.00  0.00    -0.158 NA
ATOM     33  C   LIG    1       -3.953  -2.034   0.392  0.00  0.00    +0.146 A 
ATOM     34  C   LIG    1       -4.721  -3.173   0.039  0.00  0.00    +0.068 A 
ENDBRANCH  26  33
ENDBRANCH   1  26
TORSDOF 5