REMARK  Name = BDB007733
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.278  -1.628  -1.053  0.00  0.00    +0.263 C 
ATOM      2  N   LIG    1        0.174  -2.106   0.163  0.00  0.00    -0.308 N 
ATOM      3  H   LIG    1       -0.295  -1.836   1.020  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        0.342  -1.767  -2.100  0.00  0.00    -0.269 OA
ENDROOT
BRANCH   1   9
ATOM      5  C   LIG    1       -3.813  -0.682  -0.314  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1       -3.858   0.510  -0.935  0.00  0.00    -0.221 NA
ATOM      7  C   LIG    1       -2.764   0.930  -1.589  0.00  0.00    +0.224 A 
ATOM      8  N   LIG    1       -1.603   0.286  -1.665  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1       -1.576  -0.892  -1.016  0.00  0.00    +0.130 A 
ATOM     10  C   LIG    1       -2.647  -1.423  -0.327  0.00  0.00    +0.076 A 
BRANCH   5  12
ATOM     11  C   LIG    1       -5.376  -2.489  -0.063  0.00  0.00    +0.131 C 
ATOM     12  N   LIG    1       -4.935  -1.160   0.382  0.00  0.00    -0.315 N 
BRANCH  12  13
ATOM     13  C   LIG    1       -6.044  -0.217   0.683  0.00  0.00    +0.079 C 
ATOM     14  C   LIG    1       -5.601   0.957   1.560  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1       -6.796   1.839   1.918  0.00  0.00    +0.161 C 
ATOM     16  O   LIG    1       -7.833   1.836   0.936  0.00  0.00    -0.380 OA
ATOM     17  C   LIG    1       -7.345   1.656  -0.390  0.00  0.00    +0.161 C 
ATOM     18  C   LIG    1       -6.838   0.231  -0.553  0.00  0.00    +0.050 C 
ENDBRANCH  12  13
ENDBRANCH   5  12
ENDBRANCH   1   9
BRANCH   2  19
ATOM     19  C   LIG    1        1.448  -2.800   0.298  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.645  -1.855   0.520  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.288  -0.918   1.552  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        1.660  -0.295   1.145  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        3.085  -1.126  -0.775  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        4.465  -0.583  -0.744  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        4.657   0.401   0.339  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        5.964   1.167   0.262  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        6.716   1.208  -0.924  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        7.909   1.942  -0.969  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        8.340   2.655   0.148  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.588   2.634   1.321  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        6.269   0.410  -2.119  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        6.405   1.896   1.377  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        4.785   0.033  -2.043  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 8