REMARK  Name = BDB003365
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.054  -0.040   1.060  0.00  0.00    +0.107 C 
ATOM      2  C   LIG    1        0.030  -0.897   2.288  0.00  0.00    +0.210 C 
ATOM      3  O   LIG    1        1.096  -0.974   2.900  0.00  0.00    -0.285 OA
ATOM      4  C   LIG    1       -1.146  -1.645   2.733  0.00  0.00    +0.034 A 
ATOM      5  C   LIG    1       -2.342  -1.522   2.047  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -3.468  -2.236   2.484  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -3.384  -3.069   3.601  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -2.179  -3.192   4.287  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -2.443  -0.644   0.871  0.00  0.00    +0.210 C 
ATOM     10  O   LIG    1       -3.551  -0.481   0.366  0.00  0.00    -0.285 OA
ATOM     11  C   LIG    1       -1.058  -2.480   3.856  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -1.193   0.030   0.335  0.00  0.00    +0.105 C 
ENDROOT
BRANCH   1  15
ATOM     13  O   LIG    1        0.772   2.177  -0.807  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        1.540   1.551  -0.086  0.00  0.00    +0.248 C 
ATOM     15  N   LIG    1        1.177   0.564   0.801  0.00  0.00    -0.277 N 
ATOM     16  H   LIG    1        1.882   0.290   1.488  0.00  0.00    +0.155 HD
BRANCH  14  17
ATOM     17  C   LIG    1        2.990   1.901  -0.105  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1        3.989   0.955   0.169  0.00  0.00    +0.014 A 
ATOM     19  C   LIG    1        5.336   1.329   0.133  0.00  0.00    +0.021 A 
ATOM     20  C   LIG    1        5.686   2.641  -0.185  0.00  0.00    +0.041 A 
ATOM     21 CL   LIG    1        7.344   3.095  -0.228  0.00  0.00    -0.084 Cl
ATOM     22  C   LIG    1        4.702   3.584  -0.474  0.00  0.00    +0.021 A 
ATOM     23  C   LIG    1        3.354   3.213  -0.439  0.00  0.00    +0.014 A 
ENDBRANCH  14  17
ENDBRANCH   1  15
BRANCH  12  24
ATOM     24  N   LIG    1       -1.365   0.753  -0.843  0.00  0.00    -0.310 N 
ATOM     25  H   LIG    1       -0.641   1.474  -0.965  0.00  0.00    +0.152 HD
BRANCH  24  26
ATOM     26  C   LIG    1       -1.697   0.221  -2.117  0.00  0.00    +0.032 A 
ATOM     27  C   LIG    1       -2.072  -1.110  -2.341  0.00  0.00    +0.026 A 
ATOM     28  C   LIG    1       -2.428  -1.548  -3.621  0.00  0.00    +0.040 A 
ATOM     29  C   LIG    1       -2.426  -0.652  -4.681  0.00  0.00    +0.124 A 
ATOM     30  F   LIG    1       -2.768  -1.075  -5.905  0.00  0.00    -0.205 F 
ATOM     31  C   LIG    1       -2.081   0.676  -4.486  0.00  0.00    +0.040 A 
ATOM     32  C   LIG    1       -1.727   1.111  -3.207  0.00  0.00    +0.026 A 
ENDBRANCH  24  26
ENDBRANCH  12  24
TORSDOF 4