REMARK  Name = BDB030614
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.031   0.447   1.127  0.00  0.00    +0.266 C 
ATOM      2  N   LIG    1       -0.772  -0.072   0.863  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1        0.341   0.273   1.729  0.00  0.00    +0.112 C 
ATOM      4  C   LIG    1        1.522  -0.416   1.130  0.00  0.00    +0.024 C 
ATOM      5  C   LIG    1        2.013  -0.068  -0.261  0.00  0.00    +0.085 C 
ATOM      6  C   LIG    1        1.053  -1.218  -0.033  0.00  0.00    +0.024 C 
ATOM      7  C   LIG    1       -0.423  -1.032  -0.180  0.00  0.00    +0.112 C 
ATOM      8  O   LIG    1       -2.197   1.238   2.059  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1  11
ATOM      9  N   LIG    1       -5.196  -0.111  -0.547  0.00  0.00    -0.334 N 
ATOM     10  C   LIG    1       -4.462   0.511   0.421  0.00  0.00    +0.120 A 
ATOM     11  C   LIG    1       -3.166   0.041   0.281  0.00  0.00    +0.143 A 
ATOM     12  N   LIG    1       -3.127  -0.865  -0.768  0.00  0.00    -0.231 NA
ATOM     13  C   LIG    1       -4.351  -0.929  -1.239  0.00  0.00    +0.200 A 
BRANCH   9  15
ATOM     14  C   LIG    1       -6.955   1.488  -1.221  0.00  0.00    +0.030 C 
ATOM     15  C   LIG    1       -6.620   0.054  -0.810  0.00  0.00    +0.082 C 
ATOM     16  C   LIG    1       -7.468  -0.397   0.379  0.00  0.00    +0.030 C 
ENDBRANCH   9  15
ENDBRANCH   1  11
BRANCH   5  17
ATOM     17  C   LIG    1        3.410  -0.360  -0.664  0.00  0.00    +0.217 C 
ATOM     18  N   LIG    1        4.347   0.259   0.126  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1        4.002   0.852   0.869  0.00  0.00    +0.149 HD
ATOM     20  O   LIG    1        3.636  -1.074  -1.627  0.00  0.00    -0.275 OA
BRANCH  18  21
ATOM     21  C   LIG    1        5.801   0.156  -0.058  0.00  0.00    +0.026 C 
ATOM     22  C   LIG    1        6.481   0.988   1.044  0.00  0.00    +0.031 C 
ATOM     23  C   LIG    1        6.269  -1.301   0.077  0.00  0.00    +0.031 C 
ATOM     24  C   LIG    1        6.221   0.722  -1.423  0.00  0.00    +0.031 C 
ENDBRANCH  18  21
ENDBRANCH   5  17
TORSDOF 4