REMARK  Name = BDB014804
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.590   0.346   0.190  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.893   1.266   0.479  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -5.334   3.280   0.199  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.960   1.913   0.331  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -5.103   0.819   0.317  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -3.639   0.963   0.473  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.936  -0.279   0.059  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.551  -0.576  -0.073  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -1.383  -1.843  -0.470  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.623  -2.344  -0.603  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -2.785  -3.708  -1.043  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.587  -1.447  -0.275  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -5.057  -1.628  -0.278  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.687  -0.513   0.581  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -7.182   1.805   0.431  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        0.821   0.275   0.129  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        1.530  -0.868  -0.244  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        2.932  -0.876  -0.286  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        3.676   0.263   0.048  0.00  0.00    -0.018 A 
ATOM     20  C   LIG    1        2.968   1.412   0.425  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        1.567   1.416   0.464  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        5.147   0.254   0.002  0.00  0.00    -0.018 A 
ATOM     23  C   LIG    1        5.831  -0.147  -1.158  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1        7.229  -0.156  -1.206  0.00  0.00    +0.019 A 
ATOM     25  C   LIG    1        7.971   0.236  -0.088  0.00  0.00    +0.052 A 
ATOM     26  C   LIG    1        7.307   0.637   1.074  0.00  0.00    +0.019 A 
ATOM     27  C   LIG    1        5.908   0.645   1.116  0.00  0.00    +0.010 A 
BRANCH  25  28
ATOM     28  C   LIG    1        9.403   0.228  -0.134  0.00  0.00    +0.099 C 
ATOM     29  N   LIG    1       10.563   0.222  -0.170  0.00  0.00    -0.191 NA
ENDBRANCH  25  28
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 4