REMARK  Name = BDB027705
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.749   1.226   1.027  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1       -1.587   2.136   1.691  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -2.950   1.845   1.635  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1       -3.790   2.744   2.276  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -3.405   3.861   2.949  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -2.084   4.100   2.999  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1       -3.443   0.767   1.008  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1       -2.561  -0.062   0.430  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -1.147   3.282   2.396  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -1.232   0.131   0.417  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1       -3.085  -1.264  -0.245  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1       -4.463  -1.511  -0.342  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1       -4.908  -2.654  -0.988  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1       -4.088  -3.569  -1.543  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1       -2.766  -3.330  -1.445  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1       -2.228  -2.216  -0.820  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        0.647   1.454   1.017  0.00  0.00    -0.328 N 
ATOM     18  H   LIG    1        0.818   2.384   0.643  0.00  0.00    +0.147 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.432   0.442   0.309  0.00  0.00    +0.103 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.916   0.800   0.418  0.00  0.00    +0.019 C 
BRANCH  20  21
ATOM     21  C   LIG    1        3.842  -0.256  -0.192  0.00  0.00    +0.003 C 
BRANCH  21  22
ATOM     22  C   LIG    1        3.697  -0.382  -1.713  0.00  0.00    +0.015 C 
BRANCH  22  23
ATOM     23  C   LIG    1        4.734  -1.321  -2.334  0.00  0.00    +0.077 C 
BRANCH  23  24
ATOM     24  N   LIG    1        4.568  -2.691  -1.866  0.00  0.00    -0.330 NA
ATOM     25  H   LIG    1        3.655  -3.044  -2.150  0.00  0.00    +0.118 HD
ATOM     26  H   LIG    1        5.256  -3.290  -2.322  0.00  0.00    +0.118 HD
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 8