REMARK  Name = BDB015147
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.922   0.960   0.477  0.00  0.00    -0.013 A 
ATOM      2  C   LIG    1        1.676   0.322   0.314  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1        0.571   0.693   1.083  0.00  0.00    +0.121 A 
ATOM      4  C   LIG    1        0.709   1.709   2.029  0.00  0.00    +0.045 A 
ATOM      5  C   LIG    1        1.932   2.353   2.208  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1        3.031   1.979   1.436  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        6.356  -0.254  -0.550  0.00  0.00    +0.055 A 
ATOM      8  C   LIG    1        5.274   0.120   0.253  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1        4.080   0.566  -0.335  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        4.045   0.607  -1.730  0.00  0.00    +0.119 A 
ATOM     11  N   LIG    1        5.068   0.241  -2.539  0.00  0.00    -0.262 NA
ATOM     12  C   LIG    1        6.199  -0.190  -1.928  0.00  0.00    +0.123 A 
BRANCH   7  16
ATOM     13  C   LIG    1        9.240  -0.709   1.853  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        7.960  -0.365   1.284  0.00  0.00    -0.314 N 
ATOM     15  H   LIG    1        7.448   0.391   1.717  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.646  -0.743  -0.006  0.00  0.00    +0.245 C 
ATOM     17  O   LIG    1        8.384  -1.425  -0.708  0.00  0.00    -0.270 OA
ENDBRANCH   7  16
ENDBRANCH   1   9
BRANCH   3  18
ATOM     18  O   LIG    1       -0.683   0.155   1.018  0.00  0.00    -0.489 OA
BRANCH  18  19
ATOM     19  C   LIG    1       -0.964  -0.841   0.036  0.00  0.00    +0.261 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.295  -0.241  -1.335  0.00  0.00    +0.166 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.603  -1.296  -2.254  0.00  0.00    -0.387 OA
ATOM     22  H   LIG    1       -1.823  -0.882  -3.108  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -2.391   0.859  -1.335  0.00  0.00    +0.119 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -3.756   0.599  -0.859  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -4.354  -0.646  -1.357  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -5.784  -0.845  -0.891  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.275  -0.168   0.240  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.589  -0.394   0.671  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -8.403  -1.306  -0.000  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -7.913  -1.993  -1.108  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -5.409   0.847   0.945  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -6.609  -1.767  -1.551  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -3.920   0.706   0.593  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 8