REMARK  Name = BDB016493
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.070   3.417   0.520  0.00  0.00    -0.320 N 
ATOM      2  H   LIG    1       -0.222   3.472   1.490  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   5
ATOM      3  C   LIG    1       -2.632   4.411   0.763  0.00  0.00    +0.049 C 
ATOM      4  C   LIG    1       -2.253   3.243  -0.091  0.00  0.00    +0.007 A 
ATOM      5  C   LIG    1       -0.947   2.775  -0.205  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1       -0.649   1.753  -1.018  0.00  0.00    -0.213 NA
ATOM      7  C   LIG    1       -1.655   1.143  -1.668  0.00  0.00    +0.162 A 
ATOM      8  N   LIG    1       -2.945   1.509  -1.612  0.00  0.00    -0.235 NA
ATOM      9  C   LIG    1       -3.209   2.562  -0.823  0.00  0.00    +0.120 A 
BRANCH   7  10
ATOM     10  C   LIG    1       -1.294   0.006  -2.523  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1       -1.692  -1.331  -2.256  0.00  0.00    -0.034 A 
ATOM     12  C   LIG    1       -1.254  -2.353  -3.125  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -0.466  -2.072  -4.241  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -0.083  -0.765  -4.508  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -0.487   0.259  -3.653  0.00  0.00    +0.012 A 
BRANCH  11  16
ATOM     16  C   LIG    1       -2.512  -1.693  -1.019  0.00  0.00    +0.014 C 
ATOM     17  C   LIG    1       -1.602  -2.242   0.082  0.00  0.00    +0.012 C 
ATOM     18  C   LIG    1       -3.657  -2.671  -1.312  0.00  0.00    +0.012 C 
ENDBRANCH  11  16
ENDBRANCH   7  10
ENDBRANCH   1   5
BRANCH   1  19
ATOM     19  C   LIG    1        1.474   2.956   0.420  0.00  0.00    +0.053 C 
ATOM     20  C   LIG    1        2.299   3.886   1.355  0.00  0.00    +0.036 C 
ATOM     21  C   LIG    1        2.014   3.236  -1.004  0.00  0.00    +0.036 C 
BRANCH  19  22
ATOM     22  C   LIG    1        1.635   1.511   0.926  0.00  0.00    -0.025 A 
ATOM     23  C   LIG    1        2.150   0.489   0.114  0.00  0.00    +0.006 A 
ATOM     24  C   LIG    1        2.277  -0.826   0.584  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        1.890  -1.175   1.884  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1        1.376  -0.158   2.701  0.00  0.00    +0.009 A 
ATOM     27  C   LIG    1        1.247   1.155   2.231  0.00  0.00    +0.006 A 
BRANCH  25  28
ATOM     28  C   LIG    1        2.005  -2.558   2.366  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        0.937  -3.217   2.980  0.00  0.00    +0.119 A 
ATOM     30  N   LIG    1        0.973  -4.489   3.450  0.00  0.00    -0.263 NA
ATOM     31  C   LIG    1        2.137  -5.152   3.299  0.00  0.00    +0.111 A 
ATOM     32  C   LIG    1        3.261  -4.606   2.703  0.00  0.00    +0.020 A 
ATOM     33  C   LIG    1        3.188  -3.295   2.233  0.00  0.00    +0.011 A 
ENDBRANCH  25  28
ENDBRANCH  19  22
ENDBRANCH   1  19
TORSDOF 6