REMARK  Name = BDB036925
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.346  -0.152   0.408  0.00  0.00    +0.189 A 
ATOM      2  N   LIG    1        0.232  -0.077  -0.838  0.00  0.00    -0.123 NA
ATOM      3  N   LIG    1        1.549  -0.085  -0.689  0.00  0.00    -0.064 NA
ATOM      4  N   LIG    1        1.810  -0.168   0.626  0.00  0.00    -0.239 N 
ATOM      5  C   LIG    1        0.659  -0.202   1.355  0.00  0.00    +0.146 A 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        3.174  -0.170   1.119  0.00  0.00    +0.195 C 
ATOM      7  C   LIG    1        3.942  -1.346   0.553  0.00  0.00    +0.244 C 
ATOM      8  O   LIG    1        3.807  -2.488   0.991  0.00  0.00    -0.273 OA
ATOM      9  N   LIG    1        4.812  -1.094  -0.480  0.00  0.00    -0.255 N 
ATOM     10  H   LIG    1        5.321  -1.893  -0.835  0.00  0.00    +0.158 HD
ATOM     11  C   LIG    1        5.165   0.118  -1.016  0.00  0.00    +0.219 C 
ATOM     12  O   LIG    1        6.049   0.200  -1.864  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1        4.396   1.323  -0.532  0.00  0.00    +0.099 C 
ATOM     14  C   LIG    1        3.919   1.148   0.903  0.00  0.00    +0.045 C 
ENDBRANCH   4   6
BRANCH   1  15
ATOM     15  C   LIG    1       -1.780  -0.168   0.649  0.00  0.00    +0.362 C 
ATOM     16  O   LIG    1       -2.260  -0.215   1.775  0.00  0.00    -0.243 OA
BRANCH  15  17
ATOM     17  O   LIG    1       -2.496  -0.121  -0.507  0.00  0.00    -0.454 OA
BRANCH  17  19
ATOM     18  C   LIG    1       -4.504   1.106   0.217  0.00  0.00    +0.055 C 
ATOM     19  C   LIG    1       -3.945  -0.131  -0.493  0.00  0.00    +0.106 C 
ATOM     20  C   LIG    1       -4.487  -1.432   0.110  0.00  0.00    +0.055 C 
ATOM     21  C   LIG    1       -4.350  -0.071  -1.974  0.00  0.00    +0.055 C 
ENDBRANCH  17  19
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 4