REMARK  Name = BDB014264
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.817  -0.124   0.425  0.00  0.00    +0.059 A 
ATOM      2  N   LIG    1        1.490  -0.099  -0.776  0.00  0.00    -0.353 N 
ATOM      3  H   LIG    1        1.106   0.183  -1.672  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1        2.799  -0.486  -0.598  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1        2.974  -0.726   0.758  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1        4.160  -1.102   1.292  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1        5.178  -1.199   0.415  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1        5.091  -0.986  -0.954  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.854  -0.641  -1.502  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1        1.732  -0.505   1.394  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1        3.620  -0.395  -2.941  0.00  0.00    +0.339 C 
ATOM     12  O   LIG    1        2.708   0.309  -3.344  0.00  0.00    -0.245 OA
BRANCH  11  13
ATOM     13  O   LIG    1        4.462  -1.052  -3.763  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1        4.994  -1.753  -3.345  0.00  0.00    +0.295 HD
ENDBRANCH  11  13
ENDBRANCH   9  11
BRANCH   1  15
ATOM     15  C   LIG    1       -0.640   0.239   0.522  0.00  0.00    +0.220 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -1.487  -0.961   0.986  0.00  0.00    +0.054 C 
BRANCH  16  18
ATOM     17  C   LIG    1       -2.330  -3.301   0.633  0.00  0.00    +0.007 C 
ATOM     18  C   LIG    1       -1.534  -2.152   0.008  0.00  0.00    -0.013 C 
ATOM     19  C   LIG    1       -2.148  -1.773  -1.340  0.00  0.00    +0.007 C 
ENDBRANCH  16  18
ENDBRANCH  15  16
BRANCH  15  20
ATOM     20  O   LIG    1       -0.692   1.275   1.508  0.00  0.00    -0.483 OA
BRANCH  20  21
ATOM     21  C   LIG    1       -1.663   2.232   1.418  0.00  0.00    +0.121 A 
ATOM     22  C   LIG    1       -1.499   3.304   2.300  0.00  0.00    +0.045 A 
ATOM     23  C   LIG    1       -2.416   4.356   2.325  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -3.512   4.340   1.467  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -3.688   3.272   0.590  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1       -2.768   2.218   0.566  0.00  0.00    +0.045 A 
ENDBRANCH  20  21
ENDBRANCH  15  20
ENDBRANCH   1  15
TORSDOF 7