REMARK  Name = BDB065367
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.019   0.254  -0.607  0.00  0.00    -0.251 N 
ATOM      2  N   LIG    1        0.266   1.393   0.046  0.00  0.00    -0.065 NA
ATOM      3  N   LIG    1        1.486   1.270   0.549  0.00  0.00    -0.133 NA
ATOM      4  C   LIG    1        1.969   0.034   0.201  0.00  0.00    +0.103 A 
ATOM      5  C   LIG    1        1.014  -0.629  -0.539  0.00  0.00    +0.135 A 
ENDROOT
BRANCH   1   6
ATOM      6  C   LIG    1       -1.284   0.094  -1.288  0.00  0.00    +0.146 C 
BRANCH   6   7
ATOM      7  C   LIG    1       -2.354  -0.581  -0.432  0.00  0.00    +0.034 C 
BRANCH   7   8
ATOM      8  C   LIG    1       -2.799   0.273   0.758  0.00  0.00    +0.122 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -3.950  -0.366   1.499  0.00  0.00    +0.307 C 
ATOM     10  O   LIG    1       -4.474  -1.430   1.203  0.00  0.00    -0.251 OA
BRANCH   9  11
ATOM     11  O   LIG    1       -4.315   0.431   2.543  0.00  0.00    -0.465 OA
BRANCH  11  13
ATOM     12  C   LIG    1       -6.725   0.412   2.761  0.00  0.00    +0.048 C 
ATOM     13  C   LIG    1       -5.403  -0.049   3.346  0.00  0.00    +0.229 C 
ENDBRANCH  11  13
ENDBRANCH   9  11
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   6   7
ENDBRANCH   1   6
BRANCH   4  14
ATOM     14  C   LIG    1        3.335  -0.393   0.603  0.00  0.00    +0.186 C 
BRANCH  14  15
ATOM     15  N   LIG    1        4.251  -0.173  -0.500  0.00  0.00    -0.277 N 
ATOM     16  C   LIG    1        4.500  -1.175  -1.402  0.00  0.00    +0.353 A 
ATOM     17  O   LIG    1        3.972  -2.280  -1.287  0.00  0.00    -0.244 OA
ATOM     18  N   LIG    1        5.355  -0.910  -2.430  0.00  0.00    -0.159 NA
ATOM     19  C   LIG    1        5.856   0.270  -2.550  0.00  0.00    +0.218 A 
ATOM     20  N   LIG    1        5.613   1.285  -1.686  0.00  0.00    -0.205 NA
ATOM     21  C   LIG    1        4.818   1.038  -0.710  0.00  0.00    +0.207 A 
BRANCH  19  22
ATOM     22  N   LIG    1        6.698   0.536  -3.576  0.00  0.00    -0.327 N 
ATOM     23  H   LIG    1        7.339   1.293  -3.379  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1        7.125  -0.294  -3.965  0.00  0.00    +0.145 HD
ENDBRANCH  19  22
ENDBRANCH  14  15
ENDBRANCH   4  14
TORSDOF 9