REMARK  Name = BDB003765
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.576  -2.516   2.102  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -5.041  -1.395   1.329  0.00  0.00    -0.307 N 
ATOM      3  C   LIG    1       -3.677  -1.480   0.897  0.00  0.00    +0.106 A 
ATOM      4  C   LIG    1       -2.834  -0.393   0.672  0.00  0.00    +0.163 A 
ATOM      5  N   LIG    1       -1.520  -0.562   0.371  0.00  0.00    -0.195 NA
ATOM      6  C   LIG    1       -1.015  -1.795   0.263  0.00  0.00    +0.221 A 
ATOM      7  N   LIG    1       -1.747  -2.893   0.458  0.00  0.00    -0.220 NA
ATOM      8  N   LIG    1       -3.313   0.937   0.792  0.00  0.00    -0.326 N 
ATOM      9  C   LIG    1       -2.238   1.906   1.027  0.00  0.00    +0.151 C 
ATOM     10  C   LIG    1       -4.399   1.360  -0.000  0.00  0.00    +0.056 A 
ATOM     11  C   LIG    1       -5.638   0.713   0.077  0.00  0.00    +0.063 A 
ATOM     12  C   LIG    1       -6.718   1.133  -0.728  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1       -6.576   2.184  -1.628  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -5.354   2.834  -1.722  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -4.285   2.428  -0.917  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1       -3.046  -2.708   0.772  0.00  0.00    +0.144 A 
ATOM     17  C   LIG    1       -5.936  -0.352   1.063  0.00  0.00    +0.261 A 
ATOM     18  O   LIG    1       -7.070  -0.332   1.553  0.00  0.00    -0.267 OA
ENDROOT
BRANCH   6  19
ATOM     19  N   LIG    1        0.322  -2.028  -0.038  0.00  0.00    -0.284 N 
ATOM     20  H   LIG    1        0.485  -3.025  -0.050  0.00  0.00    +0.155 HD
BRANCH  19  21
ATOM     21  C   LIG    1        1.388  -1.212  -0.427  0.00  0.00    +0.034 A 
ATOM     22  C   LIG    1        2.668  -1.779  -0.523  0.00  0.00    +0.027 A 
ATOM     23  C   LIG    1        3.789  -1.015  -0.878  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1        3.652   0.344  -1.142  0.00  0.00    +0.121 A 
ATOM     25  C   LIG    1        2.388   0.924  -1.034  0.00  0.00    +0.047 A 
ATOM     26  C   LIG    1        1.272   0.156  -0.679  0.00  0.00    +0.027 A 
BRANCH  24  27
ATOM     27  O   LIG    1        4.650   1.210  -1.490  0.00  0.00    -0.486 OA
BRANCH  27  28
ATOM     28  C   LIG    1        5.940   0.667  -1.792  0.00  0.00    +0.284 C 
BRANCH  28  29
ATOM     29  C   LIG    1        6.786   0.417  -0.562  0.00  0.00    +0.078 A 
ATOM     30  N   LIG    1        7.467  -0.758  -0.507  0.00  0.00    -0.256 NA
ATOM     31  C   LIG    1        8.235  -0.979   0.583  0.00  0.00    +0.111 A 
ATOM     32  C   LIG    1        8.368  -0.082   1.628  0.00  0.00    +0.020 A 
ATOM     33  C   LIG    1        7.672   1.118   1.555  0.00  0.00    +0.003 A 
ATOM     34  C   LIG    1        6.872   1.376   0.446  0.00  0.00    +0.027 A 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  24  27
ENDBRANCH  19  21
ENDBRANCH   6  19
TORSDOF 5