REMARK  Name = BDB025298
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.126   1.519   0.499  0.00  0.00    -0.028 A 
ATOM      2  C   LIG    1       -0.262   0.192   0.717  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -1.604  -0.157   0.485  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1       -2.373  -1.353   0.595  0.00  0.00    +0.009 A 
ATOM      5  C   LIG    1       -3.689  -1.050   0.218  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1       -3.709   0.292  -0.124  0.00  0.00    -0.313 N 
ATOM      7  C   LIG    1       -4.698  -2.029   0.229  0.00  0.00    +0.026 A 
ATOM      8  C   LIG    1       -4.362  -3.327   0.627  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -3.063  -3.647   1.004  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1       -2.062  -2.671   0.991  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1       -2.460   0.844   0.049  0.00  0.00    +0.142 A 
ATOM     12  N   LIG    1       -2.148   2.139  -0.167  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1       -0.845   2.420   0.067  0.00  0.00    +0.116 A 
ENDROOT
BRANCH   6  14
ATOM     14  C   LIG    1       -4.869   1.081  -0.535  0.00  0.00    +0.176 C 
ATOM     15  C   LIG    1       -5.603   0.484  -1.727  0.00  0.00    +0.242 C 
ATOM     16  O   LIG    1       -5.057  -0.122  -2.646  0.00  0.00    -0.273 OA
ATOM     17  N   LIG    1       -6.960   0.721  -1.784  0.00  0.00    -0.255 N 
ATOM     18  H   LIG    1       -7.435   0.347  -2.595  0.00  0.00    +0.158 HD
ATOM     19  C   LIG    1       -7.710   1.536  -0.975  0.00  0.00    +0.219 C 
ATOM     20  O   LIG    1       -8.888   1.770  -1.229  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1       -6.990   2.180   0.184  0.00  0.00    +0.099 C 
ATOM     22  C   LIG    1       -5.817   1.328   0.641  0.00  0.00    +0.044 C 
ENDBRANCH   6  14
BRANCH   1  23
ATOM     23  C   LIG    1        1.552   1.951   0.704  0.00  0.00    +0.039 C 
BRANCH  23  24
ATOM     24  C   LIG    1        2.366   1.998  -0.595  0.00  0.00    +0.033 C 
BRANCH  24  25
ATOM     25  C   LIG    1        2.622   0.624  -1.218  0.00  0.00    +0.160 C 
BRANCH  25  26
ATOM     26  O   LIG    1        3.190  -0.298  -0.289  0.00  0.00    -0.377 OA
BRANCH  26  27
ATOM     27  C   LIG    1        4.598  -0.127  -0.118  0.00  0.00    +0.188 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.105  -1.147   0.900  0.00  0.00    +0.188 C 
BRANCH  28  29
ATOM     29  O   LIG    1        6.508  -1.013   1.111  0.00  0.00    -0.376 OA
BRANCH  29  30
ATOM     30  C   LIG    1        7.284  -1.784   0.191  0.00  0.00    +0.174 C 
BRANCH  30  31
ATOM     31  C   LIG    1        8.768  -1.410   0.318  0.00  0.00    +0.105 C 
BRANCH  31  32
ATOM     32  N   LIG    1        9.073  -0.111  -0.292  0.00  0.00    -0.328 NA
ATOM     33  H   LIG    1       10.066   0.086  -0.182  0.00  0.00    +0.118 HD
ATOM     34  H   LIG    1        8.890  -0.147  -1.293  0.00  0.00    +0.118 HD
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   1  23
TORSDOF 11