REMARK  Name = BDB007983
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.216   0.428  -1.374  0.00  0.00    +0.180 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1       -0.712   0.476  -0.218  0.00  0.00    -0.294 NA
ATOM      3  C   LIG    1       -1.616   1.635  -0.298  0.00  0.00    +0.087 C 
ATOM      4  C   LIG    1       -2.932   1.346  -1.018  0.00  0.00    +0.040 C 
ATOM      5  C   LIG    1       -3.702   0.178  -0.372  0.00  0.00    +0.095 C 
ATOM      6  C   LIG    1       -2.810  -0.644   0.566  0.00  0.00    +0.040 C 
ATOM      7  C   LIG    1       -1.421  -0.806  -0.047  0.00  0.00    +0.087 C 
BRANCH   5   8
ATOM      8  N   LIG    1       -4.923   0.598   0.296  0.00  0.00    -0.289 N 
ATOM      9  C   LIG    1       -6.170  -0.045   0.192  0.00  0.00    +0.070 A 
ATOM     10  C   LIG    1       -7.048   0.587   1.075  0.00  0.00    +0.067 A 
ATOM     11  C   LIG    1       -8.361   0.203   1.224  0.00  0.00    +0.028 A 
ATOM     12  C   LIG    1       -8.796  -0.870   0.442  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1       -7.917  -1.519  -0.450  0.00  0.00    +0.002 A 
ATOM     14  N   LIG    1       -6.355   1.595   1.732  0.00  0.00    -0.306 N 
ATOM     15  H   LIG    1       -6.706   2.211   2.446  0.00  0.00    +0.170 HD
ATOM     16  C   LIG    1       -6.585  -1.108  -0.582  0.00  0.00    +0.028 A 
ATOM     17  C   LIG    1       -5.027   1.605   1.284  0.00  0.00    +0.328 A 
ATOM     18  O   LIG    1       -4.153   2.350   1.694  0.00  0.00    -0.247 OA
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  20
ATOM     19  O   LIG    1        1.905  -1.232  -1.943  0.00  0.00    -0.274 OA
ATOM     20  C   LIG    1        1.391  -0.513  -1.089  0.00  0.00    +0.227 C 
ATOM     21  N   LIG    1        1.877  -0.426   0.198  0.00  0.00    -0.307 N 
ATOM     22  H   LIG    1        1.262   0.051   0.853  0.00  0.00    +0.149 HD
BRANCH  21  23
ATOM     23  C   LIG    1        2.861  -1.359   0.709  0.00  0.00    +0.178 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.265  -0.962   0.274  0.00  0.00    +0.127 A 
ATOM     25  N   LIG    1        4.529  -1.063  -1.065  0.00  0.00    -0.309 N 
ATOM     26  H   LIG    1        3.776  -1.297  -1.709  0.00  0.00    +0.170 HD
ATOM     27  C   LIG    1        5.719  -0.681  -1.608  0.00  0.00    +0.257 A 
ATOM     28  O   LIG    1        5.929  -0.659  -2.815  0.00  0.00    -0.267 OA
ATOM     29  C   LIG    1        6.741  -0.275  -0.629  0.00  0.00    +0.064 A 
ATOM     30  C   LIG    1        8.101   0.078  -1.134  0.00  0.00    +0.202 C 
ATOM     31  O   LIG    1        9.066   0.180  -0.072  0.00  0.00    -0.375 OA
ATOM     32  C   LIG    1        8.565   0.943   1.028  0.00  0.00    +0.166 C 
ATOM     33  C   LIG    1        7.401   0.207   1.690  0.00  0.00    +0.084 C 
ATOM     34  C   LIG    1        6.388  -0.239   0.666  0.00  0.00    +0.056 A 
ATOM     35  N   LIG    1        5.141  -0.564   1.143  0.00  0.00    -0.237 NA
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH   1  20
TORSDOF 5