REMARK  Name = BDB048363
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -6.075   3.465  -0.773  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -4.586   3.248  -0.867  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -4.111   1.964  -0.632  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1       -2.664   1.773  -0.825  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -2.208   0.501  -0.204  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -0.900  -0.014  -0.018  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1       -0.952  -1.207   0.579  0.00  0.00    -0.155 NA
ATOM      8  N   LIG    1       -2.257  -1.454   0.799  0.00  0.00    -0.259 N 
ATOM      9  C   LIG    1       -3.059  -0.457   0.315  0.00  0.00    +0.048 A 
ATOM     10  C   LIG    1       -4.538  -0.321   0.339  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1       -4.963   0.758  -0.681  0.00  0.00    +0.114 C 
ATOM     12  O   LIG    1       -3.838   4.189  -1.133  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -2.623  -2.701   1.497  0.00  0.00    +0.159 C 
ATOM     14  C   LIG    1       -3.654  -3.555   0.776  0.00  0.00    +0.189 C 
ATOM     15  O   LIG    1       -4.676  -3.207   1.748  0.00  0.00    -0.375 OA
ATOM     16  C   LIG    1       -3.680  -2.557   2.581  0.00  0.00    +0.189 C 
ENDBRANCH   8  13
BRANCH   6  17
ATOM     17  N   LIG    1        0.203   0.666  -0.418  0.00  0.00    -0.298 N 
ATOM     18  H   LIG    1        0.064   1.584  -0.821  0.00  0.00    +0.154 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.579   0.345  -0.358  0.00  0.00    +0.032 A 
ATOM     20  C   LIG    1        2.509   1.287  -0.828  0.00  0.00    +0.024 A 
ATOM     21  C   LIG    1        3.887   1.033  -0.798  0.00  0.00    +0.010 A 
ATOM     22  C   LIG    1        4.378  -0.175  -0.295  0.00  0.00    -0.015 A 
ATOM     23  C   LIG    1        3.458  -1.120   0.172  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1        2.080  -0.859   0.140  0.00  0.00    +0.024 A 
BRANCH  22  25
ATOM     25  C   LIG    1        5.802  -0.460  -0.262  0.00  0.00    +0.020 A 
ATOM     26  C   LIG    1        6.805   0.483  -0.156  0.00  0.00    +0.116 A 
ATOM     27  N   LIG    1        7.983  -0.207  -0.143  0.00  0.00    -0.274 N 
ATOM     28  C   LIG    1        9.311   0.345  -0.041  0.00  0.00    +0.172 C 
ATOM     29  N   LIG    1        7.826  -1.539  -0.233  0.00  0.00    -0.179 NA
ATOM     30  C   LIG    1        6.500  -1.691  -0.301  0.00  0.00    +0.142 A 
ENDBRANCH  22  25
ENDBRANCH  17  19
ENDBRANCH   6  17
TORSDOF 4