REMARK  Name = BDB015934
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.012   1.449   0.294  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.644   0.273   0.119  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.984   0.273  -0.016  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -2.716   1.462  -0.006  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -1.971   2.613   0.181  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1       -0.634   2.638   0.341  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.591   0.182   0.432  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.194   0.229   0.286  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.457   1.423   0.449  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.181   2.587   0.766  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        3.568   2.560   0.920  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.267   1.364   0.755  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.176  -3.172  -0.363  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.906  -2.544  -0.099  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.814  -3.308   0.070  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.840  -2.417   0.273  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.303  -1.077   0.257  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.655  -1.206   0.004  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -4.154   1.530  -0.192  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -5.006   2.364   0.504  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -6.261   2.109   0.031  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -7.493   2.731   0.451  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -6.290   1.164  -0.924  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -5.007   0.819  -1.066  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.641  -0.964  -0.196  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -3.417  -1.007   0.463  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.804  -2.162  -0.103  0.00  0.00    +0.130 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -1.014  -2.429  -1.389  0.00  0.00    +0.174 C 
BRANCH  28  29
ATOM     29  O   LIG    1       -0.398  -3.716  -1.341  0.00  0.00    -0.393 OA
ATOM     30  H   LIG    1       -1.101  -4.378  -1.452  0.00  0.00    +0.209 HD
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 7