REMARK  Name = BDB018383
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.362   1.085   0.812  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1       -0.649   0.266  -0.036  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1        0.690   0.487   0.197  0.00  0.00    -0.238 N 
ATOM      4  N   LIG    1        0.857   1.508   1.085  0.00  0.00    -0.174 NA
ATOM      5  C   LIG    1       -0.375   1.827   1.480  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -3.654  -0.019   0.985  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -2.792   1.174   0.929  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -3.393   2.381   0.992  0.00  0.00    +0.101 A 
ATOM      9  N   LIG    1       -4.764   2.534   1.093  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -5.312   3.881   1.136  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -5.627   1.448   1.127  0.00  0.00    +0.255 A 
ATOM     12  O   LIG    1       -6.851   1.520   1.198  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -4.988   0.112   1.075  0.00  0.00    +0.116 A 
BRANCH   6  14
ATOM     14  O   LIG    1       -2.966  -1.213   0.957  0.00  0.00    -0.491 OA
BRANCH  14  16
ATOM     15  C   LIG    1       -4.119  -2.798  -0.483  0.00  0.00    +0.048 C 
ATOM     16  C   LIG    1       -3.662  -2.457   0.925  0.00  0.00    +0.226 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1        1.839  -0.149  -0.372  0.00  0.00    +0.086 A 
ATOM     18  C   LIG    1        1.810  -1.375  -1.059  0.00  0.00    +0.077 A 
ATOM     19  C   LIG    1        3.005  -1.889  -1.600  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1        4.219  -1.212  -1.459  0.00  0.00    +0.047 A 
ATOM     21  C   LIG    1        4.257  -0.008  -0.767  0.00  0.00    +0.123 A 
ATOM     22  C   LIG    1        3.080   0.508  -0.218  0.00  0.00    +0.074 A 
BRANCH  18  23
ATOM     23  C   LIG    1        0.655  -2.216  -1.196  0.00  0.00    +0.101 C 
ATOM     24  N   LIG    1       -0.251  -2.929  -1.330  0.00  0.00    -0.191 NA
ENDBRANCH  18  23
BRANCH  21  25
ATOM     25  O   LIG    1        5.390   0.732  -0.543  0.00  0.00    -0.489 OA
BRANCH  25  26
ATOM     26  C   LIG    1        6.519   0.457  -1.391  0.00  0.00    +0.174 C 
ATOM     27  C   LIG    1        7.824   1.027  -0.900  0.00  0.00    +0.048 C 
ATOM     28  C   LIG    1        7.579  -0.451  -0.828  0.00  0.00    +0.048 C 
ENDBRANCH  25  26
ENDBRANCH  21  25
ENDBRANCH   3  17
TORSDOF 7