REMARK  Name = BDB057406
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.566   0.197  -1.658  0.00  0.00    +0.247 C 
ATOM      2  N   LIG    1        0.432   1.136  -1.415  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1        0.483   2.023  -0.257  0.00  0.00    +0.132 C 
ATOM      4  O   LIG    1       -0.489  -0.674  -2.521  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   9
ATOM      5  N   LIG    1       -5.396   0.184   1.403  0.00  0.00    -0.303 N 
ATOM      6  C   LIG    1       -4.198   0.221   0.628  0.00  0.00    +0.068 A 
ATOM      7  C   LIG    1       -3.371  -0.914   0.579  0.00  0.00    +0.067 A 
ATOM      8  C   LIG    1       -2.184  -0.918  -0.158  0.00  0.00    +0.040 A 
ATOM      9  C   LIG    1       -1.804   0.230  -0.852  0.00  0.00    +0.039 A 
ATOM     10  C   LIG    1       -2.622   1.359  -0.846  0.00  0.00    +0.015 A 
ATOM     11  N   LIG    1       -3.719  -2.075   1.266  0.00  0.00    -0.316 N 
ATOM     12  H   LIG    1       -3.130  -2.897   1.232  0.00  0.00    +0.169 HD
ATOM     13  C   LIG    1       -4.863  -2.202   2.009  0.00  0.00    +0.314 A 
ATOM     14  O   LIG    1       -5.127  -3.243   2.597  0.00  0.00    -0.262 OA
ATOM     15  C   LIG    1       -3.809   1.354  -0.103  0.00  0.00    +0.029 A 
ATOM     16  C   LIG    1       -5.800  -0.982   2.073  0.00  0.00    +0.316 A 
ATOM     17  O   LIG    1       -6.851  -1.077   2.701  0.00  0.00    -0.262 OA
BRANCH   5  19
ATOM     18  C   LIG    1       -7.294   1.354   0.325  0.00  0.00    +0.027 C 
ATOM     19  C   LIG    1       -6.296   1.332   1.474  0.00  0.00    +0.122 C 
ENDBRANCH   5  19
ENDBRANCH   1   9
BRANCH   2  20
ATOM     20  C   LIG    1        1.583   1.152  -2.311  0.00  0.00    +0.146 C 
BRANCH  20  21
ATOM     21  C   LIG    1        2.679   0.315  -1.752  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        3.850   0.717  -1.141  0.00  0.00    +0.119 A 
ATOM     23  N   LIG    1        4.552  -0.420  -0.792  0.00  0.00    -0.240 N 
ATOM     24  N   LIG    1        3.877  -1.539  -1.163  0.00  0.00    -0.174 NA
ATOM     25  C   LIG    1        2.763  -1.091  -1.740  0.00  0.00    +0.140 A 
BRANCH  23  26
ATOM     26  C   LIG    1        5.811  -0.508  -0.135  0.00  0.00    +0.065 A 
ATOM     27  C   LIG    1        6.361  -1.772   0.135  0.00  0.00    +0.028 A 
ATOM     28  C   LIG    1        7.594  -1.882   0.780  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        8.288  -0.735   1.160  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.750   0.523   0.896  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1        6.515   0.642   0.251  0.00  0.00    +0.028 A 
ENDBRANCH  23  26
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 5