REMARK  Name = BDB053795
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.466   0.069   0.461  0.00  0.00    +0.063 A 
ATOM      2  C   LIG    1        0.408  -0.824   0.247  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1       -0.887  -0.338   0.034  0.00  0.00    -0.009 A 
ATOM      4  C   LIG    1       -1.123   1.045   0.031  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1       -0.074   1.939   0.243  0.00  0.00    +0.122 A 
ATOM      6  C   LIG    1        1.216   1.447   0.456  0.00  0.00    +0.060 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -1.983  -1.255  -0.196  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1       -2.395  -2.230   0.687  0.00  0.00    +0.142 A 
ATOM      9  C   LIG    1       -1.957  -2.679   2.023  0.00  0.00    +0.090 C 
ATOM     10  O   LIG    1       -3.456  -2.894   0.154  0.00  0.00    -0.359 OA
ATOM     11  N   LIG    1       -3.766  -2.361  -1.082  0.00  0.00    -0.083 NA
ATOM     12  C   LIG    1       -2.880  -1.379  -1.290  0.00  0.00    +0.088 A 
ATOM     13  C   LIG    1       -2.924  -0.594  -2.545  0.00  0.00    +0.070 C 
ENDBRANCH   3   7
BRANCH   1  14
ATOM     14  C   LIG    1        2.863  -0.390   0.692  0.00  0.00    +0.339 C 
ATOM     15  O   LIG    1        3.806   0.370   0.840  0.00  0.00    -0.245 OA
BRANCH  14  16
ATOM     16  O   LIG    1        2.919  -1.745   0.714  0.00  0.00    -0.461 OA
BRANCH  16  18
ATOM     17  C   LIG    1        4.954  -2.457  -0.388  0.00  0.00    +0.048 C 
ATOM     18  C   LIG    1        4.220  -2.312   0.931  0.00  0.00    +0.229 C 
ENDBRANCH  16  18
ENDBRANCH  14  16
ENDBRANCH   1  14
BRANCH   5  19
ATOM     19  O   LIG    1       -0.172   3.303   0.266  0.00  0.00    -0.492 OA
BRANCH  19  20
ATOM     20  C   LIG    1       -1.466   3.871   0.073  0.00  0.00    +0.225 C 
ATOM     21  C   LIG    1       -1.330   5.381   0.146  0.00  0.00    +0.048 C 
ENDBRANCH  19  20
ENDBRANCH   5  19
TORSDOF 6