REMARK  Name = BDB020583
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.866  -0.472  -0.209  0.00  0.00    +0.056 A 
ATOM      2  N   LIG    1        2.745   0.937  -0.352  0.00  0.00    -0.317 N 
ATOM      3  C   LIG    1        1.517   1.600  -0.399  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1        1.734   2.952  -0.556  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1        3.128   3.149  -0.609  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1        0.335   0.828  -0.276  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        0.424  -0.510  -0.155  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1        3.719   1.912  -0.481  0.00  0.00    +0.091 A 
ATOM      9  C   LIG    1        1.720  -1.210  -0.131  0.00  0.00    -0.016 A 
ATOM     10  C   LIG    1        1.654  -2.714  -0.047  0.00  0.00    +0.046 C 
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1       -0.872  -1.238   0.001  0.00  0.00    +0.245 C 
ATOM     12  N   LIG    1       -1.701  -1.125  -1.085  0.00  0.00    -0.307 N 
ATOM     13  H   LIG    1       -1.429  -0.545  -1.872  0.00  0.00    +0.149 HD
ATOM     14  O   LIG    1       -1.128  -1.887   1.008  0.00  0.00    -0.270 OA
BRANCH  12  15
ATOM     15  C   LIG    1       -3.046  -1.652  -1.096  0.00  0.00    +0.145 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -4.005  -0.552  -0.745  0.00  0.00    +0.037 A 
ATOM     17  C   LIG    1       -4.252   0.434  -1.849  0.00  0.00    +0.254 A 
ATOM     18  O   LIG    1       -3.666   0.364  -2.926  0.00  0.00    -0.268 OA
ATOM     19  N   LIG    1       -5.156   1.433  -1.593  0.00  0.00    -0.326 N 
ATOM     20  H   LIG    1       -5.306   2.086  -2.352  0.00  0.00    +0.169 HD
ATOM     21  C   LIG    1       -5.820   1.593  -0.403  0.00  0.00    +0.016 A 
ATOM     22  C   LIG    1       -6.761   2.752  -0.297  0.00  0.00    +0.063 C 
ATOM     23  C   LIG    1       -5.593   0.722   0.590  0.00  0.00    +0.024 A 
ATOM     24  C   LIG    1       -4.666  -0.390   0.424  0.00  0.00    -0.039 A 
ATOM     25  C   LIG    1       -4.531  -1.271   1.635  0.00  0.00    +0.044 C 
ENDBRANCH  15  16
ENDBRANCH  12  15
ENDBRANCH   7  11
BRANCH   1  26
ATOM     26  C   LIG    1        4.253  -1.103  -0.133  0.00  0.00    +0.162 C 
ATOM     27  C   LIG    1        4.915  -1.170  -1.510  0.00  0.00    +0.044 C 
BRANCH  26  28
ATOM     28  O   LIG    1        5.133  -0.399   0.754  0.00  0.00    -0.371 OA
BRANCH  28  30
ATOM     29  C   LIG    1        5.819   0.185   2.961  0.00  0.00    +0.034 C 
ATOM     30  C   LIG    1        4.834  -0.616   2.132  0.00  0.00    +0.157 C 
ENDBRANCH  28  30
ENDBRANCH  26  28
ENDBRANCH   1  26
TORSDOF 6