REMARK  Name = BDB002462
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.110  -0.354  -0.539  0.00  0.00    -0.286 N 
ATOM      2  H   LIG    1       -0.964  -0.429  -1.540  0.00  0.00    +0.151 HD
ATOM      3  C   LIG    1        0.008  -0.411   0.262  0.00  0.00    +0.305 C 
ATOM      4  N   LIG    1        1.114   0.055  -0.412  0.00  0.00    -0.269 N 
ATOM      5  H   LIG    1        0.920   0.518  -1.286  0.00  0.00    +0.156 HD
ATOM      6  O   LIG    1       -0.039  -0.810   1.417  0.00  0.00    -0.252 OA
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.445   0.099   0.047  0.00  0.00    +0.035 A 
ATOM      8  C   LIG    1        3.385   0.738  -0.772  0.00  0.00    +0.024 A 
ATOM      9  C   LIG    1        4.731   0.821  -0.394  0.00  0.00    +0.013 A 
ATOM     10  C   LIG    1        5.157   0.259   0.813  0.00  0.00    +0.017 A 
ATOM     11  C   LIG    1        4.220  -0.385   1.629  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        2.874  -0.465   1.248  0.00  0.00    +0.024 A 
BRANCH  10  13
ATOM     13  C   LIG    1        6.579   0.316   1.265  0.00  0.00    +0.160 C 
ATOM     14  O   LIG    1        6.912  -0.222   2.319  0.00  0.00    -0.292 OA
ATOM     15  C   LIG    1        7.587   1.038   0.409  0.00  0.00    +0.091 C 
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  16
ATOM     16  C   LIG    1       -2.411  -0.847  -0.063  0.00  0.00    +0.186 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -3.141   0.225   0.785  0.00  0.00    +0.017 C 
ATOM     18  C   LIG    1       -4.150  -0.427   1.742  0.00  0.00    +0.010 C 
BRANCH  17  20
ATOM     19  C   LIG    1       -2.919   2.193  -0.865  0.00  0.00    +0.004 C 
ATOM     20  C   LIG    1       -3.849   1.337  -0.018  0.00  0.00    +0.002 C 
ENDBRANCH  17  20
ENDBRANCH  16  17
BRANCH  16  21
ATOM     21  C   LIG    1       -3.195  -1.328  -1.291  0.00  0.00    +0.328 C 
ATOM     22  O   LIG    1       -2.844  -1.115  -2.449  0.00  0.00    -0.249 OA
BRANCH  21  23
ATOM     23  O   LIG    1       -4.297  -2.038  -0.930  0.00  0.00    -0.467 OA
ATOM     24  C   LIG    1       -5.067  -2.525  -2.030  0.00  0.00    +0.280 C 
ENDBRANCH  21  23
ENDBRANCH  16  21
ENDBRANCH   1  16
TORSDOF 7