REMARK  Name = BDB062380
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.577  -1.038  -0.319  0.00  0.00    -0.344 N 
ATOM      2  C   LIG    1       -2.804  -1.745   0.847  0.00  0.00    +0.050 A 
ATOM      3  C   LIG    1       -1.577  -2.271   1.252  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.534  -3.062   2.423  0.00  0.00    +0.010 A 
ATOM      5  C   LIG    1       -2.704  -3.295   3.152  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -3.912  -2.751   2.736  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1       -0.581  -1.830   0.318  0.00  0.00    -0.002 A 
ATOM      8  C   LIG    1       -3.983  -1.968   1.580  0.00  0.00    +0.026 A 
ATOM      9  C   LIG    1       -1.238  -1.077  -0.653  0.00  0.00    +0.021 A 
ATOM     10  C   LIG    1       -0.656  -0.406  -1.853  0.00  0.00    +0.064 C 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1       -3.624  -0.365  -1.077  0.00  0.00    +0.124 C 
BRANCH  11  12
ATOM     12  C   LIG    1       -3.736   1.111  -0.713  0.00  0.00    +0.049 C 
BRANCH  12  13
ATOM     13  C   LIG    1       -4.802   1.801  -1.557  0.00  0.00    +0.161 C 
BRANCH  13  15
ATOM     14  C   LIG    1       -4.031   4.053  -1.577  0.00  0.00    +0.193 C 
ATOM     15  O   LIG    1       -5.025   3.142  -1.127  0.00  0.00    -0.383 OA
ENDBRANCH  13  15
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   1  11
BRANCH   7  16
ATOM     16  C   LIG    1        0.881  -2.173   0.385  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  N   LIG    1        1.735  -0.980   0.453  0.00  0.00    -0.292 N 
ATOM     18  C   LIG    1        2.546  -0.706  -0.659  0.00  0.00    +0.246 C 
ATOM     19  O   LIG    1        2.468  -1.362  -1.704  0.00  0.00    -0.273 OA
BRANCH  18  20
ATOM     20  C   LIG    1        3.597   0.417  -0.533  0.00  0.00    +0.217 C 
ATOM     21  O   LIG    1        3.753   1.089  -1.800  0.00  0.00    -0.365 OA
ATOM     22  C   LIG    1        5.109   1.426  -2.108  0.00  0.00    +0.176 C 
ATOM     23  C   LIG    1        5.908   1.830  -0.861  0.00  0.00    +0.109 C 
ATOM     24  N   LIG    1        6.003   0.759   0.146  0.00  0.00    -0.311 NA
ATOM     25  H   LIG    1        6.894   0.271   0.045  0.00  0.00    +0.122 HD
ATOM     26  C   LIG    1        4.910  -0.220  -0.031  0.00  0.00    +0.122 C 
ENDBRANCH  18  20
BRANCH  17  27
ATOM     27  C   LIG    1        1.940  -0.379   1.755  0.00  0.00    +0.077 C 
ATOM     28  C   LIG    1        0.818  -0.005   2.692  0.00  0.00    +0.024 C 
ATOM     29  C   LIG    1        1.608   1.069   2.022  0.00  0.00    +0.024 C 
ENDBRANCH  17  27
ENDBRANCH  16  17
ENDBRANCH   7  16
TORSDOF 8