REMARK  Name = BDB046493
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.265  -3.135   0.236  0.00  0.00    -0.303 N 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.570  -1.990   0.388  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1       -1.939  -2.010   0.061  0.00  0.00    +0.024 A 
ATOM      4  C   LIG    1       -2.730  -0.860   0.173  0.00  0.00    +0.010 A 
ATOM      5  C   LIG    1       -2.171   0.331   0.627  0.00  0.00    -0.016 A 
ATOM      6  C   LIG    1       -0.832   0.369   1.000  0.00  0.00    +0.010 A 
ATOM      7  C   LIG    1       -0.045  -0.781   0.891  0.00  0.00    +0.024 A 
BRANCH   5   8
ATOM      8  C   LIG    1       -2.959   1.516   0.699  0.00  0.00    +0.008 C 
ATOM      9  C   LIG    1       -3.654   2.619   0.747  0.00  0.00    +0.111 C 
ATOM     10  C   LIG    1       -2.984   3.905   1.061  0.00  0.00    +0.277 C 
ATOM     11  O   LIG    1       -1.785   3.929   1.361  0.00  0.00    -0.268 OA
ATOM     12  N   LIG    1       -3.785   4.968   1.022  0.00  0.00    -0.122 NA
ATOM     13  C   LIG    1       -4.949   4.868   0.357  0.00  0.00    +0.353 C 
ATOM     14  O   LIG    1       -5.368   5.804  -0.321  0.00  0.00    -0.248 OA
ATOM     15  N   LIG    1       -5.709   3.782   0.576  0.00  0.00    -0.122 NA
ATOM     16  C   LIG    1       -5.124   2.584   0.565  0.00  0.00    +0.277 C 
ATOM     17  O   LIG    1       -5.715   1.506   0.451  0.00  0.00    -0.268 OA
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1       -0.256  -4.332  -0.425  0.00  0.00    +0.139 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -0.802  -5.592  -1.123  0.00  0.00    +0.230 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -1.275  -6.679  -1.726  0.00  0.00    -0.447 OA
BRANCH  20  22
ATOM     21  C   LIG    1       -0.993  -8.976  -2.438  0.00  0.00    +0.121 C 
ATOM     22  C   LIG    1       -0.436  -7.732  -1.741  0.00  0.00    +0.318 C 
ATOM     23  O   LIG    1        0.689  -7.881  -1.301  0.00  0.00    -0.250 OA
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
BRANCH   1  24
ATOM     24  C   LIG    1        1.689  -2.897  -0.030  0.00  0.00    +0.123 C 
BRANCH  24  25
ATOM     25  C   LIG    1        3.149  -2.501  -0.326  0.00  0.00    +0.164 C 
BRANCH  25  26
ATOM     26  O   LIG    1        4.379  -2.064  -0.579  0.00  0.00    -0.347 OA
BRANCH  26  27
ATOM     27  C   LIG    1        4.333  -0.738  -0.467  0.00  0.00    +0.167 C 
BRANCH  27  28
ATOM     28  C   LIG    1        4.237   0.683  -0.324  0.00  0.00    -0.009 A 
ATOM     29  C   LIG    1        5.364   1.434   0.016  0.00  0.00    +0.006 A 
ATOM     30  C   LIG    1        5.255   2.816   0.190  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        4.019   3.444   0.028  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        2.894   2.696  -0.314  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1        3.004   1.316  -0.496  0.00  0.00    +0.006 A 
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH   1  24
TORSDOF 11