REMARK  Name = BDB051767
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.166   0.436   1.012  0.00  0.00    +0.263 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.902  -0.064   0.324  0.00  0.00    +0.047 C 
BRANCH   2   3
ATOM      3  C   LIG    1        0.347   0.601   0.891  0.00  0.00    +0.047 C 
BRANCH   3   4
ATOM      4  C   LIG    1        1.610   0.101   0.203  0.00  0.00    +0.263 C 
BRANCH   4   5
ATOM      5  O   LIG    1        2.730   0.765   0.787  0.00  0.00    -0.394 OA
BRANCH   5   8
ATOM      6  C   LIG    1        4.908   1.905   1.760  0.00  0.00    +0.069 C 
ATOM      7  C   LIG    1        4.960   0.871   0.652  0.00  0.00    +0.084 C 
ATOM      8  N   LIG    1        3.895   0.308   0.157  0.00  0.00    -0.089 NA
BRANCH   7   9
ATOM      9  C   LIG    1        6.295   0.475   0.114  0.00  0.00    -0.001 A 
ATOM     10  C   LIG    1        6.390   0.030  -1.210  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1        7.626  -0.350  -1.740  0.00  0.00    +0.004 A 
ATOM     12  C   LIG    1        8.783  -0.288  -0.955  0.00  0.00    -0.050 A 
ATOM     13  C   LIG    1       10.103  -0.730  -1.513  0.00  0.00    +0.044 C 
ATOM     14  C   LIG    1        8.680   0.131   0.377  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        7.445   0.512   0.910  0.00  0.00    +0.010 A 
ENDBRANCH   7   9
ENDBRANCH   5   8
ENDBRANCH   4   5
ENDBRANCH   3   4
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  O   LIG    1       -3.284  -0.231   0.429  0.00  0.00    -0.394 OA
BRANCH  16  17
ATOM     17  N   LIG    1       -4.452   0.222   1.057  0.00  0.00    -0.089 NA
ATOM     18  C   LIG    1       -5.522  -0.315   0.546  0.00  0.00    +0.088 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -5.534  -1.367  -0.502  0.00  0.00    -0.001 A 
ATOM     20  C   LIG    1       -6.172  -1.136  -1.722  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1       -6.200  -2.143  -2.688  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1       -5.595  -3.375  -2.432  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -4.957  -3.603  -1.212  0.00  0.00    +0.001 A 
ATOM     24  C   LIG    1       -4.927  -2.600  -0.243  0.00  0.00    +0.010 A 
ENDBRANCH  18  19
BRANCH  18  25
ATOM     25  C   LIG    1       -6.878   0.092   1.111  0.00  0.00    +0.070 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -6.954   1.573   1.471  0.00  0.00    +0.127 C 
BRANCH  26  27
ATOM     27  C   LIG    1       -6.950   2.445   0.247  0.00  0.00    +0.305 C 
ATOM     28  O   LIG    1       -7.170   2.106  -0.903  0.00  0.00    -0.251 OA
BRANCH  27  29
ATOM     29  O   LIG    1       -6.716   3.738   0.547  0.00  0.00    -0.481 OA
ATOM     30  H   LIG    1       -6.732   4.192  -0.321  0.00  0.00    +0.295 HD
ENDBRANCH  27  29
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  18  25
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 13