REMARK  Name = BDB014874
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.209  -0.300   0.717  0.00  0.00    -0.266 N 
ATOM      2  C   LIG    1       -1.155   1.057   0.696  0.00  0.00    +0.047 A 
ATOM      3  C   LIG    1       -2.264   2.031   0.799  0.00  0.00    +0.074 C 
ATOM      4  C   LIG    1       -1.674   3.417   1.139  0.00  0.00    +0.114 C 
ATOM      5  N   LIG    1       -0.460   3.740   0.355  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1        0.665   2.787   0.421  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -0.134   5.028  -0.052  0.00  0.00    +0.213 C 
ATOM      8  O   LIG    1        1.000   5.337  -0.420  0.00  0.00    -0.276 OA
ATOM      9  C   LIG    1       -1.234   6.058  -0.044  0.00  0.00    +0.109 C 
ATOM     10  C   LIG    1        0.170   1.388   0.510  0.00  0.00    +0.032 A 
ATOM     11  C   LIG    1        0.861   0.147   0.449  0.00  0.00    +0.150 A 
ATOM     12  N   LIG    1        0.001  -0.869   0.586  0.00  0.00    -0.155 NA
ENDROOT
BRANCH  11  13
ATOM     13  N   LIG    1        2.204   0.084   0.272  0.00  0.00    -0.298 N 
ATOM     14  H   LIG    1        2.698   0.958   0.143  0.00  0.00    +0.154 HD
BRANCH  13  15
ATOM     15  C   LIG    1        3.095  -1.013   0.210  0.00  0.00    +0.033 A 
ATOM     16  C   LIG    1        4.456  -0.760  -0.048  0.00  0.00    +0.026 A 
ATOM     17  C   LIG    1        5.402  -1.795  -0.119  0.00  0.00    -0.049 A 
ATOM     18  C   LIG    1        6.837  -1.492  -0.429  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1        4.976  -3.114   0.046  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1        3.634  -3.386   0.301  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        2.706  -2.344   0.384  0.00  0.00    +0.023 A 
ENDBRANCH  13  15
ENDBRANCH  11  13
BRANCH   1  22
ATOM     22  C   LIG    1       -2.379  -1.150   0.844  0.00  0.00    +0.148 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.947  -1.533  -0.520  0.00  0.00    +0.050 C 
BRANCH  23  26
ATOM     24  C   LIG    1       -5.556  -4.440  -0.679  0.00  0.00    +0.035 C 
ATOM     25  C   LIG    1       -4.310  -3.623  -0.798  0.00  0.00    -0.034 C 
ATOM     26  C   LIG    1       -4.204  -2.350  -0.387  0.00  0.00    -0.030 C 
ENDBRANCH  23  26
ENDBRANCH  22  23
ENDBRANCH   1  22
TORSDOF 5