REMARK  Name = BDB057268
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.935  -1.585   0.736  0.00  0.00    +0.125 A 
ATOM      2  C   LIG    1        0.232  -1.224  -0.420  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1        0.578  -0.011  -1.058  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1        1.569   0.841  -0.548  0.00  0.00    +0.002 A 
ATOM      5  C   LIG    1        2.259   0.443   0.601  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1        1.960  -0.769   1.226  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        1.892   2.118  -1.172  0.00  0.00    +0.089 A 
ATOM      8  N   LIG    1        2.725   3.059  -0.569  0.00  0.00    -0.232 NA
ATOM      9  C   LIG    1        2.774   4.042  -1.428  0.00  0.00    +0.110 A 
ATOM     10  C   LIG    1        3.450   5.348  -1.535  0.00  0.00    +0.076 C 
ATOM     11  C   LIG    1        3.282   5.658  -3.045  0.00  0.00    +0.029 C 
ATOM     12  C   LIG    1        2.068   4.833  -3.517  0.00  0.00    +0.123 C 
ATOM     13  N   LIG    1        2.018   3.783  -2.525  0.00  0.00    -0.334 N 
ATOM     14  C   LIG    1        1.445   2.572  -2.407  0.00  0.00    +0.115 A 
ENDBRANCH   4   7
BRANCH   1  15
ATOM     15  O   LIG    1        0.686  -2.788   1.339  0.00  0.00    -0.492 OA
BRANCH  15  17
ATOM     16  C   LIG    1        0.569  -3.865   3.473  0.00  0.00    +0.048 C 
ATOM     17  C   LIG    1        0.182  -2.634   2.673  0.00  0.00    +0.225 C 
ENDBRANCH  15  17
ENDBRANCH   1  15
BRANCH   2  18
ATOM     18  C   LIG    1       -0.842  -2.086  -1.044  0.00  0.00    +0.146 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -2.008  -2.438  -0.221  0.00  0.00    -0.293 N 
ATOM     20  C   LIG    1       -2.809  -1.538   0.486  0.00  0.00    +0.247 C 
ATOM     21  O   LIG    1       -3.774  -1.871   1.173  0.00  0.00    -0.270 OA
BRANCH  20  22
ATOM     22  C   LIG    1       -2.524  -0.096   0.407  0.00  0.00    +0.040 A 
ATOM     23  C   LIG    1       -1.948   0.546   1.505  0.00  0.00    +0.058 A 
ATOM     24  C   LIG    1       -1.633   1.901   1.424  0.00  0.00    +0.121 A 
ATOM     25  C   LIG    1       -1.958   2.620   0.269  0.00  0.00    +0.045 A 
ATOM     26  C   LIG    1       -2.584   1.983  -0.808  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -2.870   0.620  -0.742  0.00  0.00    +0.013 A 
BRANCH  24  28
ATOM     28  O   LIG    1       -1.033   2.429   2.534  0.00  0.00    -0.495 OA
ATOM     29  C   LIG    1       -0.155   3.524   2.288  0.00  0.00    +0.277 C 
ENDBRANCH  24  28
ENDBRANCH  20  22
BRANCH  19  30
ATOM     30  C   LIG    1       -2.545  -3.784  -0.410  0.00  0.00    +0.112 C 
BRANCH  30  31
ATOM     31  C   LIG    1       -1.840  -4.781   0.454  0.00  0.00    +0.006 C 
ATOM     32  C   LIG    1       -0.654  -5.564  -0.053  0.00  0.00    +0.005 C 
ATOM     33  C   LIG    1       -1.970  -6.256   0.163  0.00  0.00    +0.005 C 
ENDBRANCH  30  31
ENDBRANCH  19  30
ENDBRANCH  18  19
ENDBRANCH   2  18
TORSDOF 9