REMARK  Name = BDB018277
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.155  -2.645  -0.265  0.00  0.00    +0.060 A 
ATOM      2  C   LIG    1        0.107  -2.820   0.505  0.00  0.00    +0.025 A 
ATOM      3  C   LIG    1        0.378  -4.034   1.030  0.00  0.00    +0.099 A 
ATOM      4  N   LIG    1       -0.428  -5.138   0.837  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1       -0.017  -6.415   1.400  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -1.534  -5.095   0.006  0.00  0.00    +0.253 A 
ATOM      7  O   LIG    1       -2.235  -6.057  -0.290  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -1.880  -3.756  -0.526  0.00  0.00    +0.097 A 
ENDROOT
BRANCH   1  11
ATOM      9  C   LIG    1       -2.103   0.863  -0.818  0.00  0.00    +0.055 A 
ATOM     10  C   LIG    1       -1.399  -0.124  -0.145  0.00  0.00    +0.104 A 
ATOM     11  N   LIG    1       -1.646  -1.376  -0.695  0.00  0.00    -0.321 N 
ATOM     12  C   LIG    1       -2.532  -1.151  -1.743  0.00  0.00    +0.092 A 
ATOM     13  C   LIG    1       -2.791   0.195  -1.860  0.00  0.00    +0.032 A 
BRANCH   9  16
ATOM     14  C   LIG    1       -2.266   1.996   1.923  0.00  0.00    +0.132 C 
ATOM     15  N   LIG    1       -2.003   2.781   0.728  0.00  0.00    -0.304 N 
ATOM     16  C   LIG    1       -2.092   2.309  -0.582  0.00  0.00    +0.248 C 
ATOM     17  O   LIG    1       -2.165   3.075  -1.543  0.00  0.00    -0.270 OA
ATOM     18  C   LIG    1       -1.748   4.194   0.942  0.00  0.00    +0.132 C 
ENDBRANCH   9  16
ENDBRANCH   1  11
BRANCH   2  19
ATOM     19  C   LIG    1        1.115  -1.805   0.616  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1        1.683  -1.100  -0.422  0.00  0.00    +0.117 A 
ATOM     21  N   LIG    1        2.583  -0.242   0.151  0.00  0.00    -0.267 N 
ATOM     22  N   LIG    1        2.693  -0.404   1.489  0.00  0.00    -0.179 NA
ATOM     23  C   LIG    1        1.786  -1.343   1.769  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1        3.423   0.721  -0.546  0.00  0.00    +0.178 C 
BRANCH  24  25
ATOM     25  C   LIG    1        2.805   2.096  -0.554  0.00  0.00    -0.026 A 
ATOM     26  C   LIG    1        3.180   3.046   0.408  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1        2.616   4.322   0.402  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        1.665   4.659  -0.558  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        1.270   3.718  -1.506  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        1.835   2.442  -1.506  0.00  0.00    +0.005 A 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH   2  19
TORSDOF 5