REMARK  Name = BDB007073
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.221  -0.728  -0.150  0.00  0.00    +0.140 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.185   0.457  -0.080  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1       -1.414   1.303  -1.187  0.00  0.00    +0.148 A 
ATOM      4  C   LIG    1       -2.309   2.389  -1.146  0.00  0.00    +0.113 A 
ATOM      5  C   LIG    1       -2.982   2.634   0.070  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -3.878   3.711   0.139  0.00  0.00    +0.011 A 
ATOM      7  C   LIG    1       -4.085   4.514  -0.974  0.00  0.00    +0.020 A 
ATOM      8  C   LIG    1       -3.384   4.213  -2.122  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1       -2.757   1.818   1.186  0.00  0.00    +0.010 A 
ATOM     10  N   LIG    1       -2.513   3.188  -2.223  0.00  0.00    -0.251 NA
ATOM     11  C   LIG    1       -1.868   0.748   1.112  0.00  0.00    +0.010 A 
BRANCH   3  12
ATOM     12  O   LIG    1       -0.768   1.081  -2.387  0.00  0.00    -0.504 OA
ATOM     13  H   LIG    1        0.148   0.797  -2.220  0.00  0.00    +0.292 HD
ENDBRANCH   3  12
ENDBRANCH   1   2
BRANCH   1  17
ATOM     14  C   LIG    1        3.779   0.585   1.047  0.00  0.00    +0.165 A 
ATOM     15  C   LIG    1        3.429   0.503  -0.311  0.00  0.00    +0.204 A 
ATOM     16  C   LIG    1        2.163   0.034  -0.706  0.00  0.00    +0.170 A 
ATOM     17  C   LIG    1        1.194  -0.289   0.260  0.00  0.00    +0.023 A 
ATOM     18  C   LIG    1        1.546  -0.165   1.618  0.00  0.00    +0.013 A 
ATOM     19  C   LIG    1        2.824   0.252   2.007  0.00  0.00    +0.050 A 
BRANCH  14  21
ATOM     20  C   LIG    1        5.451   1.051   2.684  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1        5.051   1.015   1.321  0.00  0.00    -0.491 OA
ENDBRANCH  14  21
BRANCH  15  22
ATOM     22  O   LIG    1        4.353   0.863  -1.266  0.00  0.00    -0.488 OA
ATOM     23  C   LIG    1        4.237   2.260  -1.544  0.00  0.00    +0.277 C 
ENDBRANCH  15  22
BRANCH  16  24
ATOM     24  O   LIG    1        1.783  -0.042  -2.024  0.00  0.00    -0.491 OA
ATOM     25  C   LIG    1        2.651  -0.863  -2.810  0.00  0.00    +0.277 C 
ENDBRANCH  16  24
ENDBRANCH   1  17
BRANCH   1  26
ATOM     26  N   LIG    1       -0.628  -1.851   0.724  0.00  0.00    -0.318 N 
ATOM     27  H   LIG    1        0.157  -2.483   0.858  0.00  0.00    +0.148 HD
BRANCH  26  28
ATOM     28  C   LIG    1       -1.708  -2.630   0.274  0.00  0.00    +0.122 A 
ATOM     29  C   LIG    1       -2.155  -3.699   1.070  0.00  0.00    -0.009 A 
ATOM     30  C   LIG    1       -1.508  -4.027   2.385  0.00  0.00    +0.047 C 
ATOM     31  C   LIG    1       -3.240  -4.467   0.621  0.00  0.00    +0.028 A 
ATOM     32  C   LIG    1       -3.853  -4.150  -0.583  0.00  0.00    +0.059 A 
ATOM     33 CL   LIG    1       -5.187  -5.063  -1.156  0.00  0.00    -0.082 Cl
ATOM     34  C   LIG    1       -3.357  -3.080  -1.299  0.00  0.00    +0.132 A 
ATOM     35  N   LIG    1       -2.305  -2.329  -0.897  0.00  0.00    -0.239 NA
ENDBRANCH  26  28
ENDBRANCH   1  26
TORSDOF 8