REMARK  Name = BDB001526
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.781  -2.930   0.769  0.00  0.00    +0.110 A 
ATOM      2  C   LIG    1        1.243  -1.624   0.763  0.00  0.00    +0.146 A 
ATOM      3  N   LIG    1        0.411  -0.600   0.474  0.00  0.00    -0.198 NA
ATOM      4  C   LIG    1       -0.879  -0.852   0.200  0.00  0.00    +0.221 A 
ATOM      5  N   LIG    1       -1.389  -2.089   0.190  0.00  0.00    -0.221 NA
ATOM      6  C   LIG    1       -0.550  -3.103   0.472  0.00  0.00    +0.136 A 
ENDROOT
BRANCH   1   8
ATOM      7  N   LIG    1        2.269  -4.966   1.327  0.00  0.00    -0.191 NA
ATOM      8  C   LIG    1        1.606  -4.052   1.061  0.00  0.00    +0.104 C 
ENDBRANCH   1   8
BRANCH   2   9
ATOM      9  N   LIG    1        2.609  -1.361   1.040  0.00  0.00    -0.298 N 
ATOM     10  H   LIG    1        2.913  -1.842   1.881  0.00  0.00    +0.154 HD
BRANCH   9  11
ATOM     11  C   LIG    1        3.342  -0.170   0.835  0.00  0.00    +0.033 A 
ATOM     12  C   LIG    1        3.027   0.756  -0.168  0.00  0.00    +0.027 A 
ATOM     13  C   LIG    1        3.810   1.897  -0.374  0.00  0.00    +0.047 A 
ATOM     14  C   LIG    1        4.934   2.107   0.414  0.00  0.00    +0.117 A 
ATOM     15  C   LIG    1        5.288   1.191   1.394  0.00  0.00    +0.047 A 
ATOM     16  C   LIG    1        4.502   0.053   1.595  0.00  0.00    +0.027 A 
BRANCH  14  17
ATOM     17  O   LIG    1        5.727   3.202   0.249  0.00  0.00    -0.507 OA
ATOM     18  H   LIG    1        5.361   3.743  -0.470  0.00  0.00    +0.292 HD
ENDBRANCH  14  17
ENDBRANCH   9  11
ENDBRANCH   2   9
BRANCH   4  19
ATOM     19  N   LIG    1       -1.650   0.273  -0.069  0.00  0.00    -0.284 N 
ATOM     20  H   LIG    1       -1.072   1.096   0.024  0.00  0.00    +0.155 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -2.995   0.480  -0.393  0.00  0.00    +0.034 A 
ATOM     22  C   LIG    1       -3.928  -0.550  -0.556  0.00  0.00    +0.027 A 
ATOM     23  C   LIG    1       -5.263  -0.280  -0.883  0.00  0.00    +0.047 A 
ATOM     24  C   LIG    1       -5.675   1.036  -1.050  0.00  0.00    +0.117 A 
ATOM     25  C   LIG    1       -4.775   2.079  -0.896  0.00  0.00    +0.047 A 
ATOM     26  C   LIG    1       -3.445   1.800  -0.570  0.00  0.00    +0.027 A 
BRANCH  24  27
ATOM     27  O   LIG    1       -6.963   1.345  -1.368  0.00  0.00    -0.507 OA
ATOM     28  H   LIG    1       -7.469   0.519  -1.440  0.00  0.00    +0.292 HD
ENDBRANCH  24  27
ENDBRANCH  19  21
ENDBRANCH   4  19
TORSDOF 7