REMARK  Name = BDB031518
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.055  -2.496  -0.159  0.00  0.00    +0.121 C 
ENDROOT
BRANCH   1  11
ATOM      2  C   LIG    1       -5.637   0.551   1.256  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1       -5.473   0.541  -0.236  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1       -6.306   1.041  -0.985  0.00  0.00    -0.268 OA
ATOM      5  N   LIG    1       -4.344  -0.055  -0.736  0.00  0.00    -0.321 N 
ATOM      6  H   LIG    1       -4.248  -0.048  -1.742  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1       -3.370  -0.651   0.072  0.00  0.00    +0.068 A 
ATOM      8  C   LIG    1       -3.524  -0.655   1.457  0.00  0.00    +0.088 A 
ATOM      9  N   LIG    1       -2.637  -1.208   2.310  0.00  0.00    -0.253 NA
ATOM     10  C   LIG    1       -1.544  -1.777   1.748  0.00  0.00    +0.116 A 
ATOM     11  C   LIG    1       -1.297  -1.828   0.374  0.00  0.00    -0.013 A 
ATOM     12  C   LIG    1       -2.242  -1.247  -0.479  0.00  0.00    +0.034 A 
ATOM     13  C   LIG    1       -4.708  -0.031   2.036  0.00  0.00    +0.038 A 
BRANCH   2  15
ATOM     14  C   LIG    1       -6.793   2.712   1.813  0.00  0.00    +0.009 C 
ATOM     15  C   LIG    1       -6.880   1.192   1.807  0.00  0.00    +0.037 C 
ENDBRANCH   2  15
ENDBRANCH   1  11
BRANCH   1  16
ATOM     16  N   LIG    1        1.174  -1.848   0.299  0.00  0.00    -0.295 NA
ATOM     17  C   LIG    1        1.369  -0.498  -0.256  0.00  0.00    +0.129 C 
ATOM     18  C   LIG    1        2.889  -0.250  -0.224  0.00  0.00    +0.190 C 
ATOM     19  C   LIG    1        3.479  -1.596   0.199  0.00  0.00    +0.061 C 
ATOM     20  C   LIG    1        2.371  -2.592  -0.097  0.00  0.00    +0.088 C 
BRANCH  18  21
ATOM     21  O   LIG    1        3.308   0.095  -1.551  0.00  0.00    -0.472 OA
BRANCH  21  22
ATOM     22  C   LIG    1        4.530   0.730  -1.621  0.00  0.00    +0.215 A 
ATOM     23  N   LIG    1        5.277   0.889  -0.509  0.00  0.00    -0.220 NA
ATOM     24  C   LIG    1        6.471   1.514  -0.658  0.00  0.00    +0.133 A 
ATOM     25  C   LIG    1        6.952   1.983  -1.871  0.00  0.00    +0.070 A 
ATOM     26  C   LIG    1        6.160   1.801  -3.004  0.00  0.00    +0.025 A 
ATOM     27  C   LIG    1        4.927   1.161  -2.878  0.00  0.00    +0.068 A 
BRANCH  25  28
ATOM     28  C   LIG    1        8.222   2.632  -1.947  0.00  0.00    +0.101 C 
ATOM     29  N   LIG    1        9.253   3.159  -2.009  0.00  0.00    -0.191 NA
ENDBRANCH  25  28
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH   1  16
TORSDOF 6