REMARK  Name = BDB007784
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.744  -0.955  -0.257  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1        0.039  -1.897  -0.894  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1       -0.413  -2.727  -1.256  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -0.293  -0.100   0.495  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   9
ATOM      5  C   LIG    1       -4.441  -0.601   0.264  0.00  0.00    +0.119 A 
ATOM      6  N   LIG    1       -4.952  -1.117  -0.872  0.00  0.00    -0.240 NA
ATOM      7  C   LIG    1       -4.100  -1.560  -1.821  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1       -2.726  -1.538  -1.693  0.00  0.00    +0.033 A 
ATOM      9  C   LIG    1       -2.205  -1.032  -0.507  0.00  0.00    +0.041 A 
ATOM     10  C   LIG    1       -3.070  -0.553   0.479  0.00  0.00    +0.056 A 
BRANCH   5  11
ATOM     11  N   LIG    1       -5.287  -0.164   1.290  0.00  0.00    -0.328 N 
ATOM     12  H   LIG    1       -4.970   0.727   1.660  0.00  0.00    +0.147 HD
BRANCH  11  13
ATOM     13  C   LIG    1       -6.724  -0.169   1.006  0.00  0.00    +0.118 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -7.150   1.002   0.094  0.00  0.00    +0.099 C 
BRANCH  14  16
ATOM     15  C   LIG    1       -8.996   2.161  -0.933  0.00  0.00    +0.101 C 
ATOM     16  N   LIG    1       -8.610   1.048  -0.076  0.00  0.00    -0.317 NA
ATOM     17  H   LIG    1       -8.917   0.175  -0.508  0.00  0.00    +0.122 HD
ENDBRANCH  14  16
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   5  11
ENDBRANCH   1   9
BRANCH   2  18
ATOM     18  C   LIG    1        1.460  -2.023  -0.574  0.00  0.00    +0.137 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.298  -0.870  -1.153  0.00  0.00    +0.145 C 
BRANCH  19  20
ATOM     20  O   LIG    1        2.077  -0.815  -2.574  0.00  0.00    -0.389 OA
ATOM     21  H   LIG    1        1.115  -0.694  -2.672  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        3.809  -1.063  -0.901  0.00  0.00    +0.117 C 
BRANCH  22  23
ATOM     23  N   LIG    1        4.193  -1.277   0.506  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        3.962  -0.093   1.358  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        4.973   1.021   1.191  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        6.263   0.758   0.694  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        7.194   1.800   0.589  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        6.855   3.091   0.995  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.585   3.351   1.503  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        6.623  -0.625   0.211  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        4.649   2.321   1.605  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        5.601  -1.691   0.637  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   2  18
TORSDOF 10