REMARK  Name = BDB061203
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.962  -0.113  -0.412  0.00  0.00    +0.079 A 
ATOM      2  C   LIG    1        2.430   1.180  -0.346  0.00  0.00    +0.078 A 
ATOM      3  C   LIG    1        1.079   1.339  -0.024  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        0.532   2.696   0.027  0.00  0.00    +0.144 A 
ATOM      5  N   LIG    1        1.218   3.768  -0.222  0.00  0.00    -0.179 NA
ATOM      6  N   LIG    1        2.536   3.608  -0.504  0.00  0.00    -0.243 N 
ATOM      7  H   LIG    1        3.085   4.460  -0.574  0.00  0.00    +0.192 HD
ATOM      8  C   LIG    1        0.281   0.228   0.257  0.00  0.00    +0.129 A 
ATOM      9  N   LIG    1        0.812  -1.012   0.246  0.00  0.00    -0.238 NA
ATOM     10  C   LIG    1        3.230   2.421  -0.478  0.00  0.00    +0.275 A 
ATOM     11  O   LIG    1        4.453   2.411  -0.532  0.00  0.00    -0.266 OA
ATOM     12  C   LIG    1        2.113  -1.164  -0.093  0.00  0.00    +0.139 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1        5.006  -2.110   0.874  0.00  0.00    +0.086 C 
ATOM     14  C   LIG    1        5.133  -1.405  -0.430  0.00  0.00    +0.111 A 
ATOM     15  N   LIG    1        4.255  -0.429  -0.894  0.00  0.00    -0.301 N 
ATOM     16  C   LIG    1        4.814   0.061  -2.055  0.00  0.00    +0.112 A 
ATOM     17  C   LIG    1        5.970  -0.651  -2.253  0.00  0.00    +0.131 A 
ATOM     18  N   LIG    1        6.146  -1.569  -1.259  0.00  0.00    -0.241 NA
ENDBRANCH   1  15
BRANCH   8  19
ATOM     19  N   LIG    1       -1.075   0.372   0.580  0.00  0.00    -0.324 N 
ATOM     20  H   LIG    1       -1.570   0.861  -0.159  0.00  0.00    +0.148 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -1.763  -0.860   0.957  0.00  0.00    +0.141 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -3.208  -0.550   1.229  0.00  0.00    +0.012 A 
ATOM     23  C   LIG    1       -4.165  -0.497   0.218  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1       -4.047  -0.793  -1.230  0.00  0.00    +0.080 C 
ATOM     25  C   LIG    1       -5.393  -0.246  -1.708  0.00  0.00    +0.234 C 
ATOM     26  O   LIG    1       -6.312  -0.217  -0.593  0.00  0.00    -0.491 OA
ATOM     27  C   LIG    1       -5.493  -0.205   0.505  0.00  0.00    +0.124 A 
ATOM     28  C   LIG    1       -5.932   0.050   1.788  0.00  0.00    +0.049 A 
ATOM     29  C   LIG    1       -4.989   0.019   2.815  0.00  0.00    +0.042 A 
ATOM     30  C   LIG    1       -3.647  -0.274   2.531  0.00  0.00    +0.129 A 
ATOM     31  F   LIG    1       -2.774  -0.301   3.548  0.00  0.00    -0.205 F 
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   8  19
TORSDOF 4