REMARK  Name = BDB015958
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.547   1.512   1.409  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.100   0.693   0.556  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.432   0.847   0.401  0.00  0.00    +0.132 A 
ATOM      4  C   LIG    1       -2.145   1.798   1.131  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -1.383   2.597   1.963  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1       -0.049   2.481   2.123  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.076   0.101   1.043  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.690   0.284   0.911  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.006   1.334   1.561  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.774   2.203   2.358  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        4.154   2.038   2.497  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.801   0.993   1.840  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        5.085  -4.299  -1.028  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.182  -2.943  -0.546  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        6.337  -2.270  -0.694  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        6.077  -1.083  -0.139  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.757  -0.986   0.361  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        4.207  -2.220   0.078  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.588   1.986   1.066  0.00  0.00    +0.097 A 
ATOM     20  N   LIG    1       -4.131   3.215   1.123  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -5.457   3.006   1.047  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -6.355   4.134   1.079  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -5.794   1.691   0.953  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -4.607   1.000   0.970  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.097  -0.003  -0.518  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -2.665   0.593  -1.123  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.197  -0.862  -1.308  0.00  0.00    +0.136 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -2.051  -1.780  -2.194  0.00  0.00    +0.157 C 
BRANCH  28  29
ATOM     29  O   LIG    1       -2.967  -2.532  -1.374  0.00  0.00    -0.388 OA
ATOM     30  H   LIG    1       -3.198  -1.927  -0.639  0.00  0.00    +0.210 HD
ENDBRANCH  28  29
BRANCH  28  31
ATOM     31  C   LIG    1       -1.190  -2.772  -2.974  0.00  0.00    +0.188 C 
BRANCH  31  32
ATOM     32  O   LIG    1       -2.033  -3.604  -3.771  0.00  0.00    -0.392 OA
ATOM     33  H   LIG    1       -2.759  -3.875  -3.173  0.00  0.00    +0.210 HD
ENDBRANCH  31  32
ENDBRANCH  28  31
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 9