REMARK  Name = BDB013090
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.816  -0.103  -0.069  0.00  0.00    +0.048 A 
ATOM      2  C   LIG    1        1.172  -1.336  -0.366  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1       -0.181  -1.416  -0.136  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1       -0.532  -2.691  -0.474  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        0.523  -3.346  -0.902  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -0.944  -0.350   0.357  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1       -0.344   0.775   0.640  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        1.600  -2.490  -0.836  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        1.017   0.866   0.432  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        5.977   0.578  -0.547  0.00  0.00    +0.217 A 
ATOM     11  N   LIG    1        5.551  -0.623  -0.122  0.00  0.00    -0.222 NA
ATOM     12  C   LIG    1        4.219  -0.817   0.014  0.00  0.00    +0.124 A 
ATOM     13  C   LIG    1        3.263   0.145  -0.233  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1        3.799   1.335  -0.678  0.00  0.00    +0.124 A 
ATOM     15  N   LIG    1        5.120   1.574  -0.830  0.00  0.00    -0.222 NA
BRANCH  10  17
ATOM     16  C   LIG    1        7.744   2.188  -0.712  0.00  0.00    +0.132 C 
ATOM     17  N   LIG    1        7.344   0.791  -0.722  0.00  0.00    -0.306 N 
ATOM     18  C   LIG    1        8.196  -0.145  -0.008  0.00  0.00    +0.132 C 
ENDBRANCH  10  17
ENDBRANCH   1  13
BRANCH   6  19
ATOM     19  N   LIG    1       -2.299  -0.518   0.531  0.00  0.00    -0.310 N 
ATOM     20  H   LIG    1       -2.774  -1.277   0.057  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -3.162   0.589   0.893  0.00  0.00    +0.140 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.584   0.101   0.959  0.00  0.00    -0.024 A 
ATOM     23  C   LIG    1       -5.431   0.130  -0.145  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1       -5.182   0.586  -1.534  0.00  0.00    +0.080 C 
ATOM     25  C   LIG    1       -6.619   0.592  -2.056  0.00  0.00    +0.234 C 
ATOM     26  O   LIG    1       -7.415  -0.306  -1.250  0.00  0.00    -0.491 OA
ATOM     27  C   LIG    1       -6.717  -0.388  -0.073  0.00  0.00    +0.124 A 
ATOM     28  C   LIG    1       -7.218  -0.956   1.079  0.00  0.00    +0.046 A 
ATOM     29  C   LIG    1       -6.391  -0.993   2.201  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -5.086  -0.474   2.141  0.00  0.00    +0.005 A 
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   6  19
TORSDOF 5