REMARK  Name = BDB045387
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.050  -1.158  -1.009  0.00  0.00    +0.140 C 
ATOM      2  C   LIG    1       -1.918   0.102  -1.283  0.00  0.00    +0.050 C 
ATOM      3  C   LIG    1       -2.576   0.051  -2.671  0.00  0.00    +0.026 C 
ATOM      4  C   LIG    1       -1.535  -0.232  -3.755  0.00  0.00    +0.081 C 
ATOM      5  N   LIG    1       -0.632  -1.351  -3.470  0.00  0.00    -0.313 NA
ATOM      6  H   LIG    1        0.308  -0.974  -3.320  0.00  0.00    +0.122 HD
ATOM      7  C   LIG    1       -0.995  -2.078  -2.246  0.00  0.00    +0.113 C 
ENDROOT
BRANCH   2   8
ATOM      8  C   LIG    1       -2.966   0.338  -0.203  0.00  0.00    -0.042 A 
ATOM      9  C   LIG    1       -3.947  -0.624   0.092  0.00  0.00    +0.005 A 
ATOM     10  C   LIG    1       -4.901  -0.387   1.085  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1       -4.885   0.815   1.788  0.00  0.00    +0.041 A 
ATOM     12 CL   LIG    1       -6.059   1.105   3.011  0.00  0.00    -0.084 Cl
ATOM     13  C   LIG    1       -3.925   1.783   1.506  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -2.972   1.546   0.512  0.00  0.00    +0.005 A 
ENDBRANCH   2   8
BRANCH   1  15
ATOM     15  O   LIG    1        0.307  -0.773  -0.708  0.00  0.00    -0.370 OA
BRANCH  15  16
ATOM     16  C   LIG    1        0.485  -0.379   0.654  0.00  0.00    +0.195 C 
BRANCH  16  20
ATOM     17  C   LIG    1        4.605   0.715   1.414  0.00  0.00    +0.120 A 
ATOM     18  C   LIG    1        4.309  -0.318   0.526  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        2.978  -0.668   0.272  0.00  0.00    +0.009 A 
ATOM     20  C   LIG    1        1.922   0.015   0.891  0.00  0.00    -0.022 A 
ATOM     21  C   LIG    1        2.228   1.042   1.793  0.00  0.00    +0.009 A 
ATOM     22  C   LIG    1        3.558   1.389   2.046  0.00  0.00    +0.046 A 
BRANCH  17  24
ATOM     23  C   LIG    1        6.954   0.510   1.119  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1        5.855   1.155   1.751  0.00  0.00    -0.495 OA
ENDBRANCH  17  24
ENDBRANCH  16  20
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 5