REMARK  Name = BDB001490
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.091   0.907   0.345  0.00  0.00    +0.151 A 
ATOM      2  C   LIG    1       -4.552  -0.297  -0.204  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1       -5.105  -1.698  -0.425  0.00  0.00    -0.001 C 
ATOM      4  C   LIG    1       -4.177  -2.485  -1.436  0.00  0.00    +0.050 C 
ATOM      5  C   LIG    1       -2.705  -2.189  -1.347  0.00  0.00    -0.001 A 
ATOM      6  C   LIG    1       -2.239  -0.961  -0.924  0.00  0.00    +0.097 A 
ATOM      7  N   LIG    1       -0.943  -0.620  -0.866  0.00  0.00    -0.212 NA
ATOM      8  C   LIG    1       -0.061  -1.541  -1.282  0.00  0.00    +0.220 A 
ATOM      9  N   LIG    1       -0.417  -2.750  -1.753  0.00  0.00    -0.222 NA
ATOM     10  C   LIG    1       -1.729  -3.052  -1.772  0.00  0.00    +0.120 A 
ATOM     11  C   LIG    1       -6.510  -1.699  -1.058  0.00  0.00    +0.016 C 
ATOM     12  C   LIG    1       -5.143  -2.461   0.913  0.00  0.00    +0.016 C 
ATOM     13  C   LIG    1       -3.221   0.003  -0.467  0.00  0.00    +0.092 A 
ATOM     14  N   LIG    1       -3.067   1.332  -0.210  0.00  0.00    -0.264 N 
ATOM     15  C   LIG    1       -1.892   2.150  -0.405  0.00  0.00    +0.173 C 
ATOM     16  N   LIG    1       -4.183   1.908   0.277  0.00  0.00    -0.166 NA
ENDROOT
BRANCH   1  20
ATOM     17  C   LIG    1       -7.829   3.028   1.782  0.00  0.00    +0.128 C 
ATOM     18  N   LIG    1       -6.595   2.504   1.268  0.00  0.00    -0.313 N 
ATOM     19  H   LIG    1       -5.830   3.118   0.998  0.00  0.00    +0.149 HD
ATOM     20  C   LIG    1       -6.413   1.175   0.951  0.00  0.00    +0.264 C 
ATOM     21  O   LIG    1       -7.261   0.315   1.165  0.00  0.00    -0.268 OA
ENDBRANCH   1  20
BRANCH   8  22
ATOM     22  N   LIG    1        1.307  -1.287  -1.304  0.00  0.00    -0.284 N 
ATOM     23  H   LIG    1        1.782  -2.080  -1.709  0.00  0.00    +0.155 HD
BRANCH  22  24
ATOM     24  C   LIG    1        2.115  -0.336  -0.671  0.00  0.00    +0.034 A 
ATOM     25  C   LIG    1        3.442  -0.185  -1.109  0.00  0.00    +0.028 A 
ATOM     26  C   LIG    1        4.299   0.781  -0.554  0.00  0.00    -0.032 A 
ATOM     27  C   LIG    1        3.808   1.621   0.451  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1        2.492   1.495   0.889  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        1.655   0.529   0.325  0.00  0.00    +0.023 A 
BRANCH  26  30
ATOM     30  C   LIG    1        5.723   0.925  -1.049  0.00  0.00    +0.119 C 
BRANCH  30  31
ATOM     31  N   LIG    1        6.727   0.756   0.013  0.00  0.00    -0.294 NA
ATOM     32  C   LIG    1        6.778  -0.641   0.500  0.00  0.00    +0.113 C 
ATOM     33  C   LIG    1        7.889  -0.829   1.545  0.00  0.00    +0.175 C 
ATOM     34  O   LIG    1        9.170  -0.462   1.012  0.00  0.00    -0.377 OA
ATOM     35  C   LIG    1        9.146   0.906   0.585  0.00  0.00    +0.175 C 
ATOM     36  C   LIG    1        8.067   1.132  -0.485  0.00  0.00    +0.113 C 
ENDBRANCH  30  31
ENDBRANCH  26  30
ENDBRANCH  22  24
ENDBRANCH   8  22
TORSDOF 5