REMARK  Name = BDB023603
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.769  -2.124  -0.758  0.00  0.00    -0.268 N 
ATOM      2  C   LIG    1       -3.670  -1.141  -0.506  0.00  0.00    +0.132 C 
ATOM      3  C   LIG    1       -4.137  -0.258   0.666  0.00  0.00    +0.069 C 
ATOM      4  C   LIG    1       -4.643   1.077   0.115  0.00  0.00    +0.225 C 
ATOM      5  O   LIG    1       -5.828   1.309  -0.113  0.00  0.00    -0.275 OA
ATOM      6  N   LIG    1       -3.686   2.004  -0.208  0.00  0.00    -0.285 N 
ATOM      7  H   LIG    1       -4.013   2.825  -0.703  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1       -2.349   1.918   0.190  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -1.964   0.925   1.094  0.00  0.00    -0.025 A 
ATOM     10  C   LIG    1       -0.629   0.856   1.510  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        0.328   1.759   1.017  0.00  0.00    -0.014 A 
ATOM     12  C   LIG    1       -0.089   2.751   0.115  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1       -1.423   2.838  -0.293  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -3.010   0.011   1.671  0.00  0.00    +0.054 C 
ATOM     15  C   LIG    1       -5.263  -1.076   1.304  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1       -5.910  -1.791   0.128  0.00  0.00    +0.117 C 
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1        1.733   1.677   1.453  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        2.773   1.298   0.574  0.00  0.00    +0.129 A 
ATOM     19  C   LIG    1        4.087   1.215   1.049  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1        4.384   1.527   2.377  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        3.370   1.917   3.246  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        2.055   1.987   2.788  0.00  0.00    +0.012 A 
BRANCH  18  23
ATOM     23  O   LIG    1        2.397   0.983  -0.708  0.00  0.00    -0.487 OA
BRANCH  23  24
ATOM     24  C   LIG    1        3.394   0.967  -1.732  0.00  0.00    +0.264 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.035  -0.391  -1.919  0.00  0.00    -0.010 A 
ATOM     26  C   LIG    1        5.348  -0.482  -2.405  0.00  0.00    +0.007 A 
ATOM     27  C   LIG    1        5.943  -1.728  -2.610  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        5.231  -2.895  -2.344  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        3.920  -2.818  -1.876  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        3.323  -1.573  -1.670  0.00  0.00    +0.007 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  18  23
ENDBRANCH  11  17
BRANCH   1  32
ATOM     31  N   LIG    1       -4.988  -3.434  -2.872  0.00  0.00    -0.174 NA
ATOM     32  C   LIG    1       -4.889  -2.828  -1.892  0.00  0.00    +0.169 C 
ENDBRANCH   1  32
TORSDOF 5