REMARK  Name = BDB015896
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.188   0.367  -0.149  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1        0.008   0.424   0.498  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.119   0.527  -0.238  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -1.081   0.598  -1.634  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1        0.181   0.523  -2.193  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        1.321   0.402  -1.487  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.865   0.009   0.825  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.688   0.123   0.066  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.416   0.248   0.665  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.367   0.256   2.071  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        3.526   0.143   2.842  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.768   0.019   2.221  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        9.720   0.248  -0.199  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        8.303  -0.006  -0.274  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        7.793  -0.594  -1.370  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        6.485  -0.660  -1.107  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        6.151  -0.125   0.160  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        7.363   0.293   0.671  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -2.251   0.689  -2.490  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.354   1.483  -2.258  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.241   1.217  -3.259  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.575   1.748  -3.394  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -3.767   0.347  -4.172  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -2.558   0.028  -3.702  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.340   0.623   0.442  0.00  0.00    -0.327 N 
ATOM     26  H   LIG    1       -3.067   0.102  -0.047  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -2.341   0.335   1.872  0.00  0.00    +0.122 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -3.786   0.330   2.401  0.00  0.00    +0.128 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -4.613  -0.698   1.778  0.00  0.00    -0.283 N 
ATOM     30  C   LIG    1       -5.492  -0.492   0.725  0.00  0.00    +0.302 C 
ATOM     31  O   LIG    1       -5.717   0.549   0.135  0.00  0.00    -0.253 OA
ATOM     32  N   LIG    1       -6.063  -1.713   0.410  0.00  0.00    -0.298 N 
ATOM     33  H   LIG    1       -6.587  -1.802  -0.450  0.00  0.00    +0.150 HD
ATOM     34  C   LIG    1       -5.403  -2.787   1.101  0.00  0.00    +0.124 C 
ATOM     35  C   LIG    1       -4.585  -2.087   2.181  0.00  0.00    +0.128 C 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 7