REMARK  Name = BDB003893
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.029  -2.052  -0.462  0.00  0.00    +0.055 A 
ATOM      2  C   LIG    1       -0.984  -2.729   0.188  0.00  0.00    +0.126 A 
ATOM      3  N   LIG    1       -2.280  -2.325   0.187  0.00  0.00    -0.240 NA
ATOM      4  C   LIG    1       -2.621  -1.220  -0.516  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1       -1.647  -0.509  -1.220  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1       -0.313  -0.928  -1.203  0.00  0.00    +0.018 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1       -3.934  -0.826  -0.490  0.00  0.00    -0.314 N 
ATOM      8  C   LIG    1       -4.523   0.200  -1.341  0.00  0.00    +0.122 C 
ATOM      9  C   LIG    1       -6.003   0.259  -0.871  0.00  0.00    +0.064 C 
ATOM     10  C   LIG    1       -6.852   0.781  -2.026  0.00  0.00    +0.227 C 
ATOM     11  O   LIG    1       -6.359   1.208  -3.071  0.00  0.00    -0.275 OA
ATOM     12  N   LIG    1       -8.215   0.828  -1.893  0.00  0.00    -0.256 N 
ATOM     13  H   LIG    1       -8.544   1.273  -2.745  0.00  0.00    +0.157 HD
ATOM     14  C   LIG    1       -8.803   1.485  -0.844  0.00  0.00    +0.219 C 
ATOM     15  O   LIG    1       -9.421   2.531  -1.016  0.00  0.00    -0.275 OA
ATOM     16  C   LIG    1       -8.683   0.825   0.503  0.00  0.00    +0.096 C 
ATOM     17  C   LIG    1       -7.364   1.072   1.213  0.00  0.00    +0.010 C 
ATOM     18  C   LIG    1       -6.117   1.209   0.340  0.00  0.00    +0.018 C 
ATOM     19  C   LIG    1       -6.252  -1.224  -0.561  0.00  0.00    +0.036 C 
ATOM     20  C   LIG    1       -4.944  -1.716   0.063  0.00  0.00    +0.107 C 
ENDBRANCH   4   7
BRANCH   1  26
ATOM     21  C   LIG    1        5.750   0.802   0.997  0.00  0.00    +0.403 C 
ATOM     22  N   LIG    1        4.744  -0.103   0.729  0.00  0.00    -0.264 N 
ATOM     23  C   LIG    1        3.469  -0.005   1.435  0.00  0.00    +0.130 C 
ATOM     24  C   LIG    1        2.284  -0.398   0.542  0.00  0.00    +0.127 C 
ATOM     25  N   LIG    1        2.453  -1.717  -0.090  0.00  0.00    -0.294 N 
ATOM     26  C   LIG    1        1.404  -2.580  -0.399  0.00  0.00    +0.248 C 
ATOM     27  O   LIG    1        1.566  -3.776  -0.625  0.00  0.00    -0.270 OA
ATOM     28  C   LIG    1        3.814  -2.260  -0.123  0.00  0.00    +0.127 C 
ATOM     29  C   LIG    1        4.883  -1.172  -0.263  0.00  0.00    +0.130 C 
ATOM     30  O   LIG    1        5.655   1.688   1.836  0.00  0.00    -0.226 OA
BRANCH  21  31
ATOM     31  O   LIG    1        6.839   0.592   0.215  0.00  0.00    -0.445 OA
BRANCH  31  33
ATOM     32  C   LIG    1        8.997   0.867  -0.711  0.00  0.00    +0.055 C 
ATOM     33  C   LIG    1        8.016   1.433   0.328  0.00  0.00    +0.107 C 
ATOM     34  C   LIG    1        7.701   2.887  -0.039  0.00  0.00    +0.055 C 
ATOM     35  C   LIG    1        8.654   1.315   1.716  0.00  0.00    +0.055 C 
ENDBRANCH  31  33
ENDBRANCH  21  31
ENDBRANCH   1  26
TORSDOF 4