REMARK  Name = BDB018280
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.744   2.703   0.030  0.00  0.00    +0.060 A 
ATOM      2  C   LIG    1       -0.629   2.949   0.544  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1       -1.016   4.223   0.764  0.00  0.00    +0.099 A 
ATOM      4  N   LIG    1       -0.222   5.314   0.469  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1       -0.755   6.649   0.690  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        0.999   5.174  -0.165  0.00  0.00    +0.253 A 
ATOM      7  O   LIG    1        1.707   6.098  -0.552  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        1.468   3.780  -0.349  0.00  0.00    +0.097 A 
ENDROOT
BRANCH   1  11
ATOM      9  C   LIG    1        1.854  -0.780   0.399  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1        1.050   0.294   0.743  0.00  0.00    +0.104 A 
ATOM     11  N   LIG    1        1.331   1.405  -0.036  0.00  0.00    -0.321 N 
ATOM     12  C   LIG    1        2.372   1.013  -0.872  0.00  0.00    +0.092 A 
ATOM     13  C   LIG    1        2.688  -0.308  -0.646  0.00  0.00    +0.032 A 
BRANCH   9  16
ATOM     14  N   LIG    1        2.699  -3.015   0.593  0.00  0.00    -0.312 N 
ATOM     15  H   LIG    1        3.398  -2.727  -0.073  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        1.786  -2.088   1.051  0.00  0.00    +0.246 C 
ATOM     17  O   LIG    1        0.984  -2.337   1.946  0.00  0.00    -0.270 OA
BRANCH  14  19
ATOM     18  C   LIG    1        3.712  -4.291   2.427  0.00  0.00    +0.024 C 
ATOM     19  C   LIG    1        2.824  -4.324   1.196  0.00  0.00    +0.101 C 
ENDBRANCH  14  19
ENDBRANCH   9  16
ENDBRANCH   1  11
BRANCH   2  20
ATOM     20  C   LIG    1       -1.609   1.913   0.693  0.00  0.00    +0.023 A 
ATOM     21  C   LIG    1       -2.012   1.029  -0.282  0.00  0.00    +0.117 A 
ATOM     22  N   LIG    1       -2.948   0.220   0.304  0.00  0.00    -0.267 N 
ATOM     23  N   LIG    1       -3.241   0.583   1.573  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -2.407   1.599   1.813  0.00  0.00    +0.143 A 
BRANCH  22  25
ATOM     25  C   LIG    1       -3.676  -0.880  -0.320  0.00  0.00    +0.178 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -2.761  -1.898  -0.956  0.00  0.00    -0.026 A 
ATOM     27  C   LIG    1       -1.863  -2.639  -0.174  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -1.026  -3.588  -0.764  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -1.076  -3.807  -2.138  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -1.966  -3.079  -2.926  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -2.806  -2.131  -2.339  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH   2  20
TORSDOF 6