REMARK  Name = BDB032486
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.241  -1.369   2.273  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.194  -0.165   1.477  0.00  0.00    -0.024 A 
ATOM      3  C   LIG    1       -1.300  -0.236   0.624  0.00  0.00    +0.072 A 
ATOM      4  C   LIG    1       -1.650   0.886  -0.111  0.00  0.00    +0.215 A 
ATOM      5  N   LIG    1       -0.990   2.060  -0.050  0.00  0.00    -0.221 NA
ATOM      6  C   LIG    1        0.084   2.105   0.767  0.00  0.00    +0.115 A 
ATOM      7  C   LIG    1        0.516   1.037   1.539  0.00  0.00    +0.025 A 
BRANCH   4   8
ATOM      8  O   LIG    1       -2.765   0.762  -0.912  0.00  0.00    -0.473 OA
BRANCH   8   9
ATOM      9  C   LIG    1       -3.004   1.859  -1.810  0.00  0.00    +0.184 C 
ATOM     10  C   LIG    1       -3.790   1.307  -3.015  0.00  0.00    +0.119 C 
ATOM     11  C   LIG    1       -5.236   1.093  -2.704  0.00  0.00    +0.113 A 
ATOM     12  N   LIG    1       -5.835   1.648  -1.602  0.00  0.00    -0.334 N 
ATOM     13  C   LIG    1       -7.154   1.307  -1.614  0.00  0.00    +0.107 A 
ATOM     14  C   LIG    1       -7.305   0.540  -2.747  0.00  0.00    +0.130 A 
ATOM     15  C   LIG    1       -5.147   2.435  -0.601  0.00  0.00    +0.126 C 
ATOM     16  N   LIG    1       -6.113   0.415  -3.417  0.00  0.00    -0.240 NA
ATOM     17  C   LIG    1       -3.811   2.968  -1.114  0.00  0.00    +0.066 C 
ENDBRANCH   8   9
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  N   LIG    1        1.181  -2.180   1.505  0.00  0.00    -0.340 N 
ATOM     19  H   LIG    1        0.812  -2.383   0.579  0.00  0.00    +0.146 HD
BRANCH  18  24
ATOM     20  C   LIG    1        6.729  -1.041   1.164  0.00  0.00    +0.124 A 
ATOM     21  C   LIG    1        5.341  -1.309   1.291  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1        4.660  -1.850   0.176  0.00  0.00    +0.007 A 
ATOM     23  C   LIG    1        3.271  -2.121   0.300  0.00  0.00    +0.033 A 
ATOM     24  C   LIG    1        2.537  -1.845   1.464  0.00  0.00    +0.028 A 
ATOM     25  C   LIG    1        3.238  -1.352   2.561  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        5.401  -2.093  -0.999  0.00  0.00    +0.067 A 
ATOM     27 CL   LIG    1        4.703  -2.749  -2.438  0.00  0.00    -0.081 Cl
ATOM     28  C   LIG    1        6.753  -1.790  -1.013  0.00  0.00    +0.133 A 
ATOM     29  C   LIG    1        4.607  -1.075   2.476  0.00  0.00    +0.014 A 
ATOM     30  N   LIG    1        7.424  -1.273   0.037  0.00  0.00    -0.239 NA
BRANCH  20  31
ATOM     31  N   LIG    1        7.474  -0.512   2.228  0.00  0.00    -0.343 N 
ATOM     32  H   LIG    1        7.444  -1.152   3.017  0.00  0.00    +0.144 HD
ATOM     33  H   LIG    1        7.081   0.380   2.513  0.00  0.00    +0.144 HD
ENDBRANCH  20  31
ENDBRANCH  18  24
ENDBRANCH   1  18
TORSDOF 6