REMARK  Name = BDB057328
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.110  -0.203  -0.234  0.00  0.00    -0.324 N 
ATOM      2  H   LIG    1       -2.871   0.378   0.083  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -2.409  -1.263  -1.057  0.00  0.00    +0.147 A 
ATOM      4  C   LIG    1       -3.757  -1.621  -1.447  0.00  0.00    +0.108 A 
ATOM      5  N   LIG    1       -3.878  -2.712  -2.271  0.00  0.00    -0.235 N 
ATOM      6  C   LIG    1       -5.192  -2.941  -2.559  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1       -5.940  -1.988  -1.916  0.00  0.00    +0.026 A 
ATOM      8  N   LIG    1       -2.867  -3.456  -2.738  0.00  0.00    -0.155 NA
ATOM      9  C   LIG    1       -1.705  -3.058  -2.337  0.00  0.00    +0.245 A 
ATOM     10  C   LIG    1       -5.044  -1.132  -1.199  0.00  0.00    -0.014 A 
ATOM     11  N   LIG    1       -1.439  -1.996  -1.520  0.00  0.00    -0.217 NA
BRANCH  10  12
ATOM     12  C   LIG    1       -5.535   0.035  -0.377  0.00  0.00    +0.026 C 
ATOM     13  C   LIG    1       -5.266  -0.140   1.125  0.00  0.00    +0.036 C 
ATOM     14  C   LIG    1       -5.565   1.134   1.897  0.00  0.00    +0.160 C 
ATOM     15  O   LIG    1       -4.893   2.241   1.301  0.00  0.00    -0.380 OA
ATOM     16  C   LIG    1       -5.410   2.529   0.003  0.00  0.00    +0.160 C 
ATOM     17  C   LIG    1       -5.096   1.390  -0.952  0.00  0.00    +0.036 C 
ENDBRANCH  10  12
ENDBRANCH   1   3
BRANCH   1  21
ATOM     18  C   LIG    1        2.185   0.229   0.271  0.00  0.00    +0.057 C 
ATOM     19  C   LIG    1        1.397   1.281  -0.548  0.00  0.00    +0.021 C 
ATOM     20  C   LIG    1        0.033   0.761  -1.004  0.00  0.00    +0.024 C 
ATOM     21  C   LIG    1       -0.800   0.273   0.179  0.00  0.00    +0.072 C 
ATOM     22  C   LIG    1       -0.051  -0.757   1.022  0.00  0.00    +0.024 C 
ATOM     23  C   LIG    1        1.310  -0.223   1.466  0.00  0.00    +0.021 C 
BRANCH  18  29
ATOM     24  C   LIG    1        8.591  -0.612   0.378  0.00  0.00    +0.109 C 
ATOM     25  C   LIG    1        7.835   0.690   0.308  0.00  0.00    +0.213 C 
ATOM     26  N   LIG    1        6.458   0.625   0.417  0.00  0.00    -0.299 N 
ATOM     27  C   LIG    1        5.680   1.854   0.284  0.00  0.00    +0.123 C 
ATOM     28  C   LIG    1        4.235   1.577  -0.169  0.00  0.00    +0.103 C 
ATOM     29  N   LIG    1        3.486   0.722   0.772  0.00  0.00    -0.296 NA
ATOM     30  C   LIG    1        4.341  -0.347   1.341  0.00  0.00    +0.103 C 
ATOM     31  C   LIG    1        5.688  -0.600   0.632  0.00  0.00    +0.123 C 
ATOM     32  O   LIG    1        8.440   1.753   0.162  0.00  0.00    -0.276 OA
ENDBRANCH  18  29
ENDBRANCH   1  21
TORSDOF 4