REMARK  Name = BDB018970
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.890  -0.062  -0.615  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1        2.549  -0.934   0.426  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1        1.204  -1.172   0.765  0.00  0.00    -0.025 A 
ATOM      4  C   LIG    1        0.897  -2.121   1.893  0.00  0.00    +0.038 C 
ATOM      5  C   LIG    1       -0.530  -2.638   1.802  0.00  0.00    +0.024 C 
ATOM      6  C   LIG    1       -1.483  -1.462   1.645  0.00  0.00    +0.111 C 
ATOM      7  N   LIG    1       -1.189  -0.707   0.413  0.00  0.00    -0.298 N 
ATOM      8  C   LIG    1        0.167  -0.519   0.070  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        0.525   0.350  -0.974  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1        1.863   0.573  -1.317  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1       -2.307  -0.589  -0.457  0.00  0.00    +0.057 A 
ATOM     12  C   LIG    1       -3.438   0.182  -0.091  0.00  0.00    +0.071 A 
ATOM     13  N   LIG    1       -3.483   0.814   1.181  0.00  0.00    -0.330 N 
ATOM     14  H   LIG    1       -2.527   1.053   1.445  0.00  0.00    +0.147 HD
ATOM     15  C   LIG    1       -4.400   1.966   1.237  0.00  0.00    +0.154 C 
ATOM     16  C   LIG    1       -5.755   1.699   0.551  0.00  0.00    +0.237 C 
ATOM     17  N   LIG    1       -5.710   0.905  -0.569  0.00  0.00    -0.282 N 
ATOM     18  H   LIG    1       -6.569   0.810  -1.092  0.00  0.00    +0.155 HD
ATOM     19  O   LIG    1       -6.811   2.233   0.889  0.00  0.00    -0.273 OA
ATOM     20  C   LIG    1       -4.598   2.364   2.694  0.00  0.00    +0.038 C 
ATOM     21  C   LIG    1       -4.560   0.198  -0.944  0.00  0.00    +0.056 A 
ATOM     22  C   LIG    1       -4.553  -0.491  -2.156  0.00  0.00    +0.025 A 
ATOM     23  C   LIG    1       -3.419  -1.204  -2.538  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -2.306  -1.252  -1.696  0.00  0.00    +0.025 A 
ENDBRANCH   7  11
BRANCH   1  26
ATOM     25  C   LIG    1        5.216   0.519  -0.071  0.00  0.00    +0.077 C 
ATOM     26  C   LIG    1        4.296   0.175  -0.991  0.00  0.00    +0.013 C 
BRANCH  25  28
ATOM     27  C   LIG    1        7.507   0.787   0.880  0.00  0.00    +0.125 C 
ATOM     28  N   LIG    1        6.575   0.710  -0.227  0.00  0.00    -0.352 N 
ATOM     29  H   LIG    1        6.960   0.271  -1.067  0.00  0.00    +0.145 HD
ENDBRANCH  25  28
BRANCH  26  30
ATOM     30  C   LIG    1        4.712  -0.003  -2.412  0.00  0.00    +0.111 C 
ATOM     31  N   LIG    1        5.605   0.695  -3.034  0.00  0.00    -0.307 NA
ATOM     32  H   LIG    1        5.965   1.418  -2.391  0.00  0.00    +0.186 HD
ENDBRANCH  26  30
ENDBRANCH   1  26
TORSDOF 4