REMARK  Name = BDB032244
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.103   0.165  -1.545  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1       -1.649  -1.069  -1.829  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.314  -1.232  -1.981  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1        0.617  -0.210  -1.862  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1        0.122   1.064  -1.579  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -1.249   1.254  -1.423  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1       -3.483   0.276  -1.416  0.00  0.00    -0.321 N 
ATOM      8  H   LIG    1       -3.840  -0.668  -1.559  0.00  0.00    +0.148 HD
BRANCH   7  14
ATOM      9  C   LIG    1       -8.581  -0.335   1.230  0.00  0.00    +0.068 C 
ATOM     10  C   LIG    1       -7.430   0.312   0.560  0.00  0.00    +0.063 A 
ATOM     11  C   LIG    1       -6.067   0.045   0.703  0.00  0.00    -0.002 A 
ATOM     12  C   LIG    1       -5.105  -0.819   1.401  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -3.735  -0.120   1.063  0.00  0.00    +0.033 C 
ATOM     14  C   LIG    1       -3.972   0.845  -0.171  0.00  0.00    +0.121 C 
ATOM     15  C   LIG    1       -5.440   0.917  -0.134  0.00  0.00    +0.060 A 
ATOM     16  N   LIG    1       -6.386   1.640  -0.761  0.00  0.00    -0.279 N 
ATOM     17  H   LIG    1       -6.288   2.354  -1.476  0.00  0.00    +0.189 HD
ATOM     18  N   LIG    1       -7.629   1.305  -0.332  0.00  0.00    -0.179 NA
ENDBRANCH   7  14
ENDBRANCH   1   7
BRANCH   4  19
ATOM     19  C   LIG    1        2.087  -0.461  -2.059  0.00  0.00    +0.138 C 
BRANCH  19  20
ATOM     20  N   LIG    1        2.809  -0.095  -0.847  0.00  0.00    -0.339 N 
ATOM     21  H   LIG    1        2.347  -0.462  -0.018  0.00  0.00    +0.146 HD
BRANCH  20  22
ATOM     22  C   LIG    1        4.204  -0.286  -0.757  0.00  0.00    +0.035 A 
ATOM     23  C   LIG    1        4.868  -0.078   0.495  0.00  0.00    +0.008 A 
ATOM     24  C   LIG    1        6.272  -0.251   0.588  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1        6.888  -0.053   1.845  0.00  0.00    +0.124 A 
ATOM     26  N   LIG    1        6.223   0.283   2.963  0.00  0.00    -0.240 NA
ATOM     27  C   LIG    1        4.895   0.462   2.852  0.00  0.00    +0.113 A 
ATOM     28  C   LIG    1        6.995  -0.608  -0.568  0.00  0.00    +0.012 A 
ATOM     29  C   LIG    1        6.361  -0.753  -1.795  0.00  0.00    +0.003 A 
ATOM     30  C   LIG    1        4.192   0.304   1.671  0.00  0.00    +0.030 A 
ATOM     31  C   LIG    1        4.983  -0.576  -1.889  0.00  0.00    +0.023 A 
BRANCH  25  32
ATOM     32  N   LIG    1        8.270  -0.191   2.022  0.00  0.00    -0.343 N 
ATOM     33  H   LIG    1        8.446   0.037   2.998  0.00  0.00    +0.144 HD
ATOM     34  H   LIG    1        8.768   0.438   1.403  0.00  0.00    +0.144 HD
ENDBRANCH  25  32
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH   4  19
TORSDOF 6