REMARK  Name = BDB002738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.870  -0.516   0.090  0.00  0.00    -0.268 N 
ATOM      2  H   LIG    1       -0.941   0.467  -0.158  0.00  0.00    +0.156 HD
ATOM      3  C   LIG    1        0.417  -1.021   0.233  0.00  0.00    +0.309 C 
ATOM      4  N   LIG    1        1.343  -0.018  -0.008  0.00  0.00    -0.254 N 
ATOM      5  H   LIG    1        0.988   0.892  -0.241  0.00  0.00    +0.158 HD
ATOM      6  O   LIG    1        0.675  -2.179   0.528  0.00  0.00    -0.252 OA
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.737  -0.156   0.043  0.00  0.00    +0.126 A 
ATOM      8  N   LIG    1        3.309  -1.331   0.346  0.00  0.00    -0.240 NA
ATOM      9  C   LIG    1        4.657  -1.390   0.384  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1        5.483  -0.311   0.125  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1        4.893   0.906  -0.204  0.00  0.00    -0.046 A 
ATOM     12  C   LIG    1        5.732   2.121  -0.462  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1        3.495   0.982  -0.232  0.00  0.00    +0.047 A 
ENDBRANCH   4   7
BRANCH   1  15
ATOM     14  C   LIG    1       -3.316  -0.449   0.043  0.00  0.00    +0.080 A 
ATOM     15  C   LIG    1       -2.115  -1.176   0.241  0.00  0.00    +0.049 A 
ATOM     16  C   LIG    1       -2.204  -2.532   0.581  0.00  0.00    +0.024 A 
ATOM     17  C   LIG    1       -3.445  -3.160   0.724  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1       -4.620  -2.445   0.530  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -4.558  -1.095   0.191  0.00  0.00    +0.017 A 
BRANCH  14  20
ATOM     20  C   LIG    1       -3.268   1.003  -0.321  0.00  0.00    +0.341 C 
ATOM     21  O   LIG    1       -2.225   1.629  -0.466  0.00  0.00    -0.245 OA
BRANCH  20  23
ATOM     22  C   LIG    1       -4.543   2.902  -0.815  0.00  0.00    +0.280 C 
ATOM     23  O   LIG    1       -4.515   1.517  -0.466  0.00  0.00    -0.464 OA
ENDBRANCH  20  23
ENDBRANCH  14  20
ENDBRANCH   1  15
TORSDOF 4