REMARK  Name = BDB027848
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.065  -0.652  -0.144  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1        0.495  -1.996  -0.283  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1        1.878  -2.244  -0.310  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1        2.264  -3.569  -0.453  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        1.435  -4.640  -0.560  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        0.119  -4.373  -0.509  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.802  -1.270  -0.200  0.00  0.00    -0.245 NA
ATOM      8  C   LIG    1        2.392   0.009  -0.038  0.00  0.00    +0.074 A 
ATOM      9  C   LIG    1       -0.389  -3.094  -0.372  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1        1.041   0.343  -0.015  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  16
ATOM     11  C   LIG    1       -3.852   2.027   1.412  0.00  0.00    +0.043 C 
ATOM     12  C   LIG    1       -3.364   0.814   0.614  0.00  0.00    +0.080 C 
ATOM     13  O   LIG    1       -3.830   1.002  -0.742  0.00  0.00    -0.371 OA
ATOM     14  C   LIG    1       -2.801   0.909  -1.734  0.00  0.00    +0.179 C 
ATOM     15  C   LIG    1       -1.892  -0.313  -1.536  0.00  0.00    +0.133 C 
ATOM     16  N   LIG    1       -1.305  -0.336  -0.175  0.00  0.00    -0.324 N 
ATOM     17  C   LIG    1       -1.815   0.709   0.731  0.00  0.00    +0.139 C 
ATOM     18  C   LIG    1       -4.045  -0.450   1.154  0.00  0.00    +0.043 C 
ENDBRANCH   1  16
BRANCH   8  19
ATOM     19  C   LIG    1        3.470   1.010   0.085  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1        4.696   0.826  -0.571  0.00  0.00    +0.030 A 
ATOM     21  C   LIG    1        5.691   1.783  -0.444  0.00  0.00    +0.111 A 
ATOM     22  N   LIG    1        5.558   2.907   0.288  0.00  0.00    -0.263 NA
ATOM     23  C   LIG    1        4.384   3.072   0.929  0.00  0.00    +0.111 A 
ATOM     24  C   LIG    1        3.332   2.170   0.860  0.00  0.00    +0.030 A 
ENDBRANCH   8  19
TORSDOF 2