REMARK  Name = BDB065096
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.084  -0.164  -0.306  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1       -4.156  -0.985   0.354  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1       -2.836  -0.552   0.480  0.00  0.00    +0.062 A 
ATOM      4  C   LIG    1       -2.421   0.696  -0.050  0.00  0.00    +0.044 A 
ATOM      5  C   LIG    1       -3.348   1.497  -0.727  0.00  0.00    +0.081 A 
ATOM      6  N   LIG    1       -3.022   2.670  -1.274  0.00  0.00    -0.218 NA
ATOM      7  C   LIG    1       -1.742   3.053  -1.156  0.00  0.00    +0.234 A 
ATOM      8  N   LIG    1       -0.770   2.382  -0.521  0.00  0.00    -0.203 NA
ATOM      9  C   LIG    1       -1.112   1.212   0.038  0.00  0.00    +0.131 A 
ATOM     10  C   LIG    1       -4.661   1.059  -0.839  0.00  0.00    +0.078 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -7.333   0.152  -1.056  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1       -6.367  -0.644  -0.385  0.00  0.00    -0.491 OA
ENDBRANCH   1  12
BRANCH   2  13
ATOM     13  O   LIG    1       -4.636  -2.173   0.844  0.00  0.00    -0.491 OA
ATOM     14  C   LIG    1       -3.695  -3.103   1.363  0.00  0.00    +0.277 C 
ENDBRANCH   2  13
BRANCH   7  15
ATOM     15  C   LIG    1       -1.378   4.311  -1.753  0.00  0.00    +0.140 C 
ATOM     16  N   LIG    1       -1.081   5.330  -2.232  0.00  0.00    -0.188 NA
ENDBRANCH   7  15
BRANCH   9  17
ATOM     17  N   LIG    1       -0.129   0.474   0.734  0.00  0.00    -0.326 N 
ATOM     18  H   LIG    1       -0.469   0.332   1.683  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        1.248   1.006   0.721  0.00  0.00    +0.074 C 
ATOM     20  C   LIG    1        1.895   0.786  -0.655  0.00  0.00    +0.037 C 
ATOM     21  C   LIG    1        3.403   0.581  -0.530  0.00  0.00    +0.086 C 
ATOM     22  N   LIG    1        3.732  -0.645   0.208  0.00  0.00    -0.300 NA
ATOM     23  C   LIG    1        2.800  -0.916   1.316  0.00  0.00    +0.086 C 
ATOM     24  C   LIG    1        2.068   0.324   1.828  0.00  0.00    +0.037 C 
BRANCH  22  25
ATOM     25  C   LIG    1        5.156  -0.774   0.585  0.00  0.00    +0.050 C 
ATOM     26  C   LIG    1        5.502  -2.246   0.874  0.00  0.00    +0.024 C 
ATOM     27  C   LIG    1        6.135  -0.281  -0.496  0.00  0.00    +0.024 C 
ENDBRANCH  22  25
ENDBRANCH  17  19
ENDBRANCH   9  17
TORSDOF 6