REMARK  Name = BDB034314
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.668   1.284   0.033  0.00  0.00    +0.034 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.020  -0.086  -0.056  0.00  0.00    +0.086 C 
BRANCH   2   3
ATOM      3  N   LIG    1       -0.785  -0.366  -1.287  0.00  0.00    -0.298 NA
BRANCH   3   4
ATOM      4  C   LIG    1        0.095  -0.424  -2.467  0.00  0.00    +0.084 C 
BRANCH   4   6
ATOM      5  C   LIG    1       -0.919  -2.597  -3.343  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1       -0.511  -1.167  -3.667  0.00  0.00    +0.012 C 
ENDBRANCH   4   6
ENDBRANCH   3   4
BRANCH   3   7
ATOM      7  C   LIG    1       -1.927   0.543  -1.495  0.00  0.00    +0.119 C 
BRANCH   7   8
ATOM      8  C   LIG    1       -2.951   0.508  -0.379  0.00  0.00    -0.033 A 
ATOM      9  C   LIG    1       -3.588  -0.693  -0.036  0.00  0.00    +0.005 A 
ATOM     10  C   LIG    1       -4.540  -0.728   0.985  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -4.874   0.438   1.683  0.00  0.00    -0.048 A 
ATOM     12  C   LIG    1       -4.250   1.641   1.334  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -3.297   1.676   0.312  0.00  0.00    +0.005 A 
BRANCH  11  14
ATOM     14  C   LIG    1       -5.915   0.404   2.773  0.00  0.00    +0.032 C 
ATOM     15  C   LIG    1       -7.313   0.656   2.229  0.00  0.00    +0.009 C 
ENDBRANCH  11  14
ENDBRANCH   7   8
ENDBRANCH   3   7
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  C   LIG    1        1.403   1.478   1.363  0.00  0.00    +0.103 C 
BRANCH  16  17
ATOM     17  N   LIG    1        2.551   0.586   1.516  0.00  0.00    -0.343 N 
ATOM     18  H   LIG    1        2.271  -0.383   1.629  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        3.733   0.727   0.770  0.00  0.00    +0.038 A 
ATOM     20  C   LIG    1        4.716  -0.309   0.767  0.00  0.00    +0.021 A 
ATOM     21  C   LIG    1        5.899  -0.099   0.015  0.00  0.00    +0.074 A 
ATOM     22  C   LIG    1        6.867  -1.091  -0.036  0.00  0.00    +0.048 A 
ATOM     23  C   LIG    1        6.710  -2.291   0.650  0.00  0.00    +0.043 A 
ATOM     24  C   LIG    1        5.574  -2.518   1.410  0.00  0.00    +0.021 A 
ATOM     25 CL   LIG    1        7.936  -3.495   0.564  0.00  0.00    -0.083 Cl
ATOM     26  N   LIG    1        6.147   1.032  -0.658  0.00  0.00    -0.255 NA
ATOM     27  C   LIG    1        5.235   2.017  -0.585  0.00  0.00    +0.113 A 
ATOM     28  C   LIG    1        4.586  -1.534   1.470  0.00  0.00    +0.013 A 
ATOM     29  C   LIG    1        4.046   1.918   0.112  0.00  0.00    +0.043 A 
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 10