REMARK  Name = BDB014223
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.996  -0.122   0.120  0.00  0.00    +0.086 A 
ATOM      2  C   LIG    1       -1.827  -0.886   0.191  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1       -1.757  -2.016   0.996  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1       -0.462  -2.566   0.857  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1        0.243  -1.767  -0.026  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1       -2.791  -2.452   1.752  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -3.910  -1.703   1.673  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1       -0.602  -0.753  -0.421  0.00  0.00    -0.354 N 
ATOM      9  H   LIG    1       -0.362  -0.008  -1.068  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1       -4.068  -0.564   0.899  0.00  0.00    +0.037 A 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1       -3.047   1.076  -0.748  0.00  0.00    +0.341 C 
ATOM     12  O   LIG    1       -2.111   1.440  -1.442  0.00  0.00    -0.245 OA
BRANCH  11  14
ATOM     13  C   LIG    1       -4.382   2.851  -1.463  0.00  0.00    +0.280 C 
ATOM     14  O   LIG    1       -4.256   1.681  -0.653  0.00  0.00    -0.464 OA
ENDBRANCH  11  14
ENDBRANCH   1  11
BRANCH   5  15
ATOM     15  C   LIG    1        1.642  -1.868  -0.538  0.00  0.00    +0.191 C 
BRANCH  15  16
ATOM     16  C   LIG    1        2.469  -0.628  -0.255  0.00  0.00    -0.013 A 
ATOM     17  C   LIG    1        2.858  -0.343   1.067  0.00  0.00    +0.010 A 
ATOM     18  C   LIG    1        3.617   0.796   1.373  0.00  0.00    -0.050 A 
ATOM     19  C   LIG    1        3.988   1.101   2.794  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1        3.972   1.673   0.344  0.00  0.00    +0.003 A 
ATOM     21  C   LIG    1        3.595   1.404  -0.972  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        2.851   0.262  -1.269  0.00  0.00    +0.006 A 
ENDBRANCH  15  16
BRANCH  15  23
ATOM     23  O   LIG    1        1.517  -2.110  -1.936  0.00  0.00    -0.381 OA
ATOM     24  H   LIG    1        0.997  -2.927  -2.020  0.00  0.00    +0.211 HD
ENDBRANCH  15  23
ENDBRANCH   5  15
TORSDOF 5