REMARK  Name = BDB015902
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.692   2.020   0.223  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.130   1.098  -0.314  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.439   1.393  -0.440  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -1.941   2.639  -0.063  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -1.010   3.518   0.462  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.298   3.240   0.623  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.901  -0.042   0.331  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.556   0.330   0.172  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.111   1.651   0.396  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.075   2.595   0.793  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.416   2.242   0.956  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.827   0.929   0.726  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        6.534  -4.047  -0.960  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.487  -3.174  -0.489  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.319  -3.702  -0.083  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.603  -2.632   0.275  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.306  -1.417   0.096  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.530  -1.813  -0.404  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.330   3.032  -0.215  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -4.055   3.757   0.710  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -5.308   3.900   0.185  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.429   4.583   0.783  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.453   3.317  -1.018  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.248   2.797  -1.264  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.291   0.419  -0.996  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -3.127   0.327  -0.422  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.696  -0.874  -1.334  0.00  0.00    +0.107 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -1.492  -1.764  -0.108  0.00  0.00    +0.021 C 
ATOM     29  C   LIG    1       -0.779  -3.062  -0.456  0.00  0.00    +0.086 C 
ATOM     30  N   LIG    1       -1.073  -3.892   0.709  0.00  0.00    -0.316 NA
ATOM     31  H   LIG    1       -0.885  -4.875   0.519  0.00  0.00    +0.122 HD
ATOM     32  C   LIG    1       -2.487  -3.671   1.007  0.00  0.00    +0.081 C 
ATOM     33  C   LIG    1       -2.787  -2.247   0.547  0.00  0.00    +0.021 C 
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6