REMARK  Name = BDB015162
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.683  -1.624  -0.119  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        1.595  -0.772   0.130  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        1.006  -0.019  -0.894  0.00  0.00    +0.122 A 
ATOM      4  C   LIG    1        1.482  -0.141  -2.198  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.541  -1.005  -2.471  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        3.132  -1.742  -1.442  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        2.365  -2.886   1.977  0.00  0.00    +0.138 C 
ATOM      8  N   LIG    1        3.262  -2.398   0.940  0.00  0.00    -0.269 N 
ATOM      9  C   LIG    1        4.591  -2.866   0.968  0.00  0.00    +0.270 C 
ATOM     10  O   LIG    1        4.911  -3.880   1.601  0.00  0.00    -0.268 OA
BRANCH   9  11
ATOM     11  C   LIG    1        5.644  -2.061   0.314  0.00  0.00    +0.144 A 
ATOM     12  N   LIG    1        5.554  -0.703   0.032  0.00  0.00    -0.231 NA
ATOM     13  C   LIG    1        6.706  -0.372  -0.508  0.00  0.00    +0.199 A 
ATOM     14  N   LIG    1        7.551  -1.438  -0.565  0.00  0.00    -0.339 N 
ATOM     15  C   LIG    1        8.906  -1.400  -1.064  0.00  0.00    +0.150 C 
ATOM     16  C   LIG    1        6.901  -2.522  -0.050  0.00  0.00    +0.119 A 
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  O   LIG    1       -0.019   0.792  -0.490  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -0.535   1.712  -1.455  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.564   2.633  -0.790  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -2.002   3.615  -1.742  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -2.753   4.046  -1.284  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.773   1.846  -0.234  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.828   2.795   0.203  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -4.287   2.506   1.573  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -5.021   1.189   1.685  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -5.888   0.810   0.650  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -6.596  -0.394   0.743  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -6.434  -1.223   1.857  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -5.578  -0.843   2.890  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -6.104   1.756  -0.506  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -4.875   0.359   2.807  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -4.984   2.808  -0.718  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 8