REMARK  Name = BDB051600
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.597   0.051  -0.343  0.00  0.00    -0.239 N 
ATOM      2  N   LIG    1       -1.451  -0.943   0.042  0.00  0.00    -0.165 NA
ATOM      3  C   LIG    1       -2.687  -0.403   0.015  0.00  0.00    +0.109 A 
ATOM      4  C   LIG    1       -2.586   0.971  -0.401  0.00  0.00    +0.063 A 
ATOM      5  C   LIG    1       -3.627   1.890  -0.561  0.00  0.00    +0.131 A 
ATOM      6  C   LIG    1       -4.873   1.307  -0.255  0.00  0.00    +0.047 A 
ATOM      7  C   LIG    1       -5.030  -0.053   0.164  0.00  0.00    +0.019 A 
ATOM      8  C   LIG    1       -3.950  -0.958   0.315  0.00  0.00    +0.064 A 
ATOM      9  C   LIG    1       -1.259   1.224  -0.618  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        3.572  -0.727  -0.562  0.00  0.00    -0.033 A 
ATOM     11  C   LIG    1        2.676  -1.727  -0.166  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1        1.304  -1.466  -0.097  0.00  0.00    +0.028 A 
ATOM     13  C   LIG    1        0.805  -0.195  -0.421  0.00  0.00    +0.065 A 
ATOM     14  C   LIG    1        1.698   0.810  -0.814  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1        3.070   0.542  -0.882  0.00  0.00    +0.007 A 
BRANCH  10  16
ATOM     16  C   LIG    1        5.056  -1.002  -0.638  0.00  0.00    +0.116 C 
BRANCH  16  18
ATOM     17  C   LIG    1        7.203  -0.541   0.346  0.00  0.00    +0.101 C 
ATOM     18  N   LIG    1        5.780  -0.238   0.378  0.00  0.00    -0.315 NA
ATOM     19  H   LIG    1        5.401  -0.474   1.295  0.00  0.00    +0.122 HD
ENDBRANCH  16  18
ENDBRANCH  10  16
ENDBRANCH   1  13
BRANCH   8  20
ATOM     20  C   LIG    1       -4.172  -2.347   0.750  0.00  0.00    +0.244 C 
ATOM     21  O   LIG    1       -5.298  -2.763   0.993  0.00  0.00    -0.270 OA
ATOM     22  N   LIG    1       -3.076  -3.150   0.869  0.00  0.00    -0.325 N 
ATOM     23  H   LIG    1       -2.143  -2.798   0.666  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -3.197  -4.107   1.166  0.00  0.00    +0.145 HD
ENDBRANCH   8  20
BRANCH   5  25
ATOM     25  O   LIG    1       -3.377   3.163  -0.965  0.00  0.00    -0.494 OA
ATOM     26  C   LIG    1       -4.506   4.019  -1.092  0.00  0.00    +0.277 C 
ENDBRANCH   5  25
TORSDOF 5