REMARK  Name = BDB007873
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.808  -2.633   1.129  0.00  0.00    -0.293 N 
ATOM      2  C   LIG    1       -1.977  -1.601   1.541  0.00  0.00    +0.233 C 
ATOM      3  O   LIG    1       -2.362  -0.635   2.185  0.00  0.00    -0.274 OA
ATOM      4  C   LIG    1       -0.555  -1.930   1.046  0.00  0.00    +0.145 C 
ATOM      5  C   LIG    1       -0.890  -2.831  -0.157  0.00  0.00    +0.047 C 
ATOM      6  C   LIG    1       -2.141  -3.574   0.272  0.00  0.00    +0.110 C 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        0.236  -0.730   0.708  0.00  0.00    -0.291 NA
ATOM      8  C   LIG    1        1.444  -1.036  -0.064  0.00  0.00    +0.086 C 
ATOM      9  C   LIG    1        2.233   0.239  -0.366  0.00  0.00    +0.027 C 
ATOM     10  C   LIG    1        2.669   0.973   0.908  0.00  0.00    +0.063 C 
ATOM     11  C   LIG    1        1.984   0.394   2.152  0.00  0.00    +0.027 C 
ATOM     12  C   LIG    1        0.505   0.104   1.896  0.00  0.00    +0.086 C 
BRANCH  10  13
ATOM     13  C   LIG    1        4.189   0.909   1.052  0.00  0.00    +0.166 C 
ATOM     14  O   LIG    1        4.738   0.020   1.703  0.00  0.00    -0.292 OA
BRANCH  13  15
ATOM     15  C   LIG    1        5.043   1.928   0.364  0.00  0.00    +0.018 A 
ATOM     16  C   LIG    1        6.416   1.943   0.654  0.00  0.00    +0.015 A 
ATOM     17  C   LIG    1        7.270   2.869   0.043  0.00  0.00    +0.046 A 
ATOM     18  C   LIG    1        6.761   3.792  -0.868  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1        5.396   3.774  -1.164  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1        4.538   2.850  -0.557  0.00  0.00    +0.015 A 
BRANCH  18  21
ATOM     21  O   LIG    1        7.476   4.749  -1.531  0.00  0.00    -0.495 OA
ATOM     22  C   LIG    1        8.868   4.828  -1.243  0.00  0.00    +0.277 C 
ENDBRANCH  18  21
ENDBRANCH  13  15
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  23
ATOM     23  C   LIG    1       -4.230  -2.693   1.414  0.00  0.00    +0.182 C 
BRANCH  23  26
ATOM     24  C   LIG    1       -6.389  -1.620  -1.396  0.00  0.00    +0.048 A 
ATOM     25  N   LIG    1       -5.741  -2.438  -0.498  0.00  0.00    -0.237 NA
ATOM     26  C   LIG    1       -4.979  -1.867   0.382  0.00  0.00    +0.127 A 
ATOM     27  N   LIG    1       -4.787  -0.512   0.450  0.00  0.00    -0.310 N 
ATOM     28  H   LIG    1       -4.121  -0.123   1.113  0.00  0.00    +0.170 HD
ATOM     29  C   LIG    1       -5.342   0.343  -0.451  0.00  0.00    +0.252 A 
ATOM     30  O   LIG    1       -5.126   1.548  -0.469  0.00  0.00    -0.268 OA
ATOM     31  C   LIG    1       -6.236  -0.288  -1.432  0.00  0.00    +0.093 A 
BRANCH  24  33
ATOM     32  C   LIG    1       -8.543  -2.873  -1.728  0.00  0.00    +0.010 C 
ATOM     33  C   LIG    1       -7.286  -2.324  -2.388  0.00  0.00    +0.052 C 
ENDBRANCH  24  33
ENDBRANCH  23  26
ENDBRANCH   1  23
TORSDOF 7