REMARK  Name = BDB014267
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.798  -0.483   0.426  0.00  0.00    +0.086 A 
ATOM      2  C   LIG    1       -2.568   0.107   0.122  0.00  0.00    +0.080 A 
ATOM      3  C   LIG    1       -2.507   1.351  -0.496  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1       -1.142   1.681  -0.672  0.00  0.00    +0.059 A 
ATOM      5  C   LIG    1       -0.391   0.641  -0.163  0.00  0.00    +0.085 A 
ATOM      6  N   LIG    1       -3.606   2.063  -0.839  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -4.784   1.477  -0.537  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1       -1.270  -0.302   0.313  0.00  0.00    -0.350 N 
ATOM      9  H   LIG    1       -1.004  -1.179   0.746  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1       -4.937   0.244   0.076  0.00  0.00    +0.037 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        1.022   0.453  -0.083  0.00  0.00    +0.152 A 
ATOM     12  O   LIG    1        1.575  -0.673   0.471  0.00  0.00    -0.453 OA
ATOM     13  C   LIG    1        2.928  -0.550   0.397  0.00  0.00    +0.136 A 
ATOM     14  C   LIG    1        3.270   0.653  -0.203  0.00  0.00    +0.021 A 
ATOM     15  C   LIG    1        4.632   0.960  -0.368  0.00  0.00    +0.011 A 
ATOM     16  C   LIG    1        5.587   0.036   0.081  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        5.202  -1.166   0.681  0.00  0.00    +0.004 A 
ATOM     18  C   LIG    1        3.851  -1.487   0.853  0.00  0.00    +0.047 A 
ATOM     19  C   LIG    1        2.039   1.290  -0.508  0.00  0.00    +0.060 A 
ENDBRANCH   5  11
BRANCH   1  21
ATOM     20  O   LIG    1       -4.999  -2.334   1.355  0.00  0.00    -0.245 OA
ATOM     21  C   LIG    1       -3.944  -1.796   1.079  0.00  0.00    +0.339 C 
BRANCH  21  22
ATOM     22  O   LIG    1       -2.765  -2.382   1.359  0.00  0.00    -0.477 OA
ATOM     23  H   LIG    1       -3.028  -3.229   1.781  0.00  0.00    +0.295 HD
ENDBRANCH  21  22
ENDBRANCH   1  21
TORSDOF 3