REMARK  Name = BDB018098
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.231  -0.247  -0.303  0.00  0.00    +0.102 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1       -4.053  -0.490  -0.184  0.00  0.00    +0.063 C 
ATOM      3  C   LIG    1       -3.131   0.714  -0.418  0.00  0.00    +0.030 C 
ATOM      4  C   LIG    1       -1.669   0.406  -0.115  0.00  0.00    +0.108 C 
ATOM      5  N   LIG    1       -1.170  -0.766  -0.831  0.00  0.00    -0.301 N 
ATOM      6  C   LIG    1        0.171  -1.050  -1.056  0.00  0.00    +0.216 C 
ATOM      7  O   LIG    1        0.525  -1.954  -1.815  0.00  0.00    -0.276 OA
ATOM      8  C   LIG    1       -2.170  -1.669  -1.405  0.00  0.00    +0.108 C 
ATOM      9  C   LIG    1       -3.350  -1.831  -0.454  0.00  0.00    +0.030 C 
BRANCH   2  10
ATOM     10  C   LIG    1       -5.289  -0.340  -1.075  0.00  0.00    +0.169 C 
ATOM     11  O   LIG    1       -5.313  -0.835  -2.202  0.00  0.00    -0.292 OA
BRANCH  10  16
ATOM     12  C   LIG    1       -8.452   2.452   1.613  0.00  0.00    +0.172 C 
ATOM     13  N   LIG    1       -7.825   1.661   0.581  0.00  0.00    -0.274 N 
ATOM     14  N   LIG    1       -8.486   1.428  -0.564  0.00  0.00    -0.179 NA
ATOM     15  C   LIG    1       -7.636   0.682  -1.273  0.00  0.00    +0.145 A 
ATOM     16  C   LIG    1       -6.424   0.432  -0.589  0.00  0.00    +0.055 A 
ATOM     17  C   LIG    1       -6.584   1.089   0.617  0.00  0.00    +0.119 A 
ENDBRANCH  10  16
ENDBRANCH   2  10
ENDBRANCH   1   6
BRANCH   1  18
ATOM     18  C   LIG    1        1.901  -1.008   0.873  0.00  0.00    -0.020 C 
ATOM     19  C   LIG    1        0.836  -1.495   1.878  0.00  0.00    +0.012 C 
ATOM     20  C   LIG    1        2.680  -2.238   0.365  0.00  0.00    +0.012 C 
BRANCH  18  21
ATOM     21  C   LIG    1        2.860  -0.061   1.652  0.00  0.00    +0.081 C 
BRANCH  21  22
ATOM     22  C   LIG    1        4.008   0.503   0.836  0.00  0.00    +0.113 A 
ATOM     23  N   LIG    1        3.770   1.736   0.249  0.00  0.00    -0.310 N 
ATOM     24  H   LIG    1        2.899   2.223   0.386  0.00  0.00    +0.170 HD
ATOM     25  C   LIG    1        4.694   2.408  -0.527  0.00  0.00    +0.261 A 
ATOM     26  O   LIG    1        4.462   3.507  -1.017  0.00  0.00    -0.267 OA
ATOM     27  C   LIG    1        5.928   1.682  -0.679  0.00  0.00    +0.083 A 
ATOM     28  C   LIG    1        7.135   1.937  -1.367  0.00  0.00    +0.034 A 
ATOM     29  C   LIG    1        7.960   0.853  -1.141  0.00  0.00    +0.088 A 
ATOM     30  N   LIG    1        7.285  -0.040  -0.342  0.00  0.00    -0.335 N 
ATOM     31  C   LIG    1        7.793  -1.311   0.118  0.00  0.00    +0.150 C 
ATOM     32  C   LIG    1        6.045   0.461  -0.050  0.00  0.00    +0.148 A 
ATOM     33  N   LIG    1        5.120  -0.164   0.720  0.00  0.00    -0.216 NA
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH   1  18
TORSDOF 6