REMARK  Name = BDB063575
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.915  -1.292   1.378  0.00  0.00    +0.267 C 
ATOM      2  N   LIG    1       -2.108  -0.909   0.786  0.00  0.00    -0.278 N 
ATOM      3  H   LIG    1       -2.052  -0.444  -0.112  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1       -0.781  -1.750   2.505  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1        2.450  -0.323   0.391  0.00  0.00    +0.220 A 
ATOM      6  N   LIG    1        1.354  -0.515   1.130  0.00  0.00    -0.210 NA
ATOM      7  C   LIG    1        0.296  -1.091   0.521  0.00  0.00    +0.131 A 
ATOM      8  C   LIG    1        0.287  -1.489  -0.796  0.00  0.00    +0.053 A 
ATOM      9  C   LIG    1        1.452  -1.246  -1.470  0.00  0.00    +0.116 A 
ATOM     10  N   LIG    1        2.525  -0.666  -0.905  0.00  0.00    -0.223 NA
BRANCH   5  11
ATOM     11  N   LIG    1        3.514   0.268   1.065  0.00  0.00    -0.284 N 
ATOM     12  H   LIG    1        3.249   0.398   2.032  0.00  0.00    +0.155 HD
BRANCH  11  16
ATOM     13  C   LIG    1        7.480   1.387   0.119  0.00  0.00    +0.052 A 
ATOM     14  C   LIG    1        6.673   0.818  -0.866  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        5.357   0.439  -0.569  0.00  0.00    +0.024 A 
ATOM     16  C   LIG    1        4.821   0.614   0.711  0.00  0.00    +0.034 A 
ATOM     17  C   LIG    1        5.648   1.194   1.688  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        6.964   1.576   1.401  0.00  0.00    +0.020 A 
BRANCH  13  20
ATOM     19  N   LIG    1        9.916   2.092  -0.428  0.00  0.00    -0.191 NA
ATOM     20  C   LIG    1        8.826   1.776  -0.184  0.00  0.00    +0.099 C 
ENDBRANCH  13  20
ENDBRANCH  11  16
ENDBRANCH   5  11
ENDBRANCH   1   7
BRANCH   2  21
ATOM     21  C   LIG    1       -3.409  -1.007   1.344  0.00  0.00    +0.060 A 
ATOM     22  C   LIG    1       -4.508  -0.505   0.612  0.00  0.00    +0.006 A 
ATOM     23  C   LIG    1       -5.795  -0.616   1.160  0.00  0.00    +0.030 A 
ATOM     24  C   LIG    1       -5.950  -1.212   2.398  0.00  0.00    +0.111 A 
ATOM     25  N   LIG    1       -4.925  -1.702   3.119  0.00  0.00    -0.261 NA
ATOM     26  C   LIG    1       -3.683  -1.589   2.581  0.00  0.00    +0.134 A 
BRANCH  22  27
ATOM     27  C   LIG    1       -4.358   0.129  -0.707  0.00  0.00    -0.016 A 
ATOM     28  C   LIG    1       -3.987   1.480  -0.813  0.00  0.00    +0.011 A 
ATOM     29  C   LIG    1       -3.824   2.075  -2.066  0.00  0.00    +0.039 A 
ATOM     30  C   LIG    1       -4.036   1.322  -3.214  0.00  0.00    +0.123 A 
ATOM     31  F   LIG    1       -3.877   1.892  -4.415  0.00  0.00    -0.205 F 
ATOM     32  C   LIG    1       -4.407  -0.014  -3.135  0.00  0.00    +0.039 A 
ATOM     33  C   LIG    1       -4.569  -0.611  -1.883  0.00  0.00    +0.011 A 
ENDBRANCH  22  27
ENDBRANCH   2  21
TORSDOF 6