REMARK  Name = BDB016389
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.319  -0.855  -0.492  0.00  0.00    +0.007 A 
ATOM      2  C   LIG    1       -1.095  -0.754  -0.290  0.00  0.00    +0.057 A 
ATOM      3  N   LIG    1       -1.539   0.041   0.781  0.00  0.00    -0.339 N 
ATOM      4  H   LIG    1       -0.867   0.772   1.012  0.00  0.00    +0.146 HD
ATOM      5  C   LIG    1       -2.909   0.531   0.821  0.00  0.00    +0.076 C 
ATOM      6  C   LIG    1       -3.829  -0.623   1.149  0.00  0.00    +0.118 C 
ATOM      7  C   LIG    1       -4.245  -1.307  -0.111  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1       -3.332  -1.676  -1.044  0.00  0.00    -0.284 N 
ATOM      9  H   LIG    1       -3.781  -2.205  -1.782  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1       -5.429  -1.596  -0.308  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1       -3.001   1.600   1.915  0.00  0.00    +0.028 C 
ATOM     12  C   LIG    1       -1.931  -1.534  -1.127  0.00  0.00    +0.055 A 
ATOM     13  C   LIG    1       -1.362  -2.275  -2.184  0.00  0.00    +0.025 A 
ATOM     14  C   LIG    1        0.011  -2.320  -2.395  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        0.851  -1.626  -1.541  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  17
ATOM     16  C   LIG    1        2.118   0.773  -0.096  0.00  0.00    +0.077 C 
ATOM     17  C   LIG    1        1.287  -0.165   0.395  0.00  0.00    +0.015 C 
BRANCH  17  18
ATOM     18  C   LIG    1        1.353  -0.546   1.835  0.00  0.00    +0.111 C 
ATOM     19  N   LIG    1        1.657   0.247   2.811  0.00  0.00    -0.307 NA
ATOM     20  H   LIG    1        1.816   1.193   2.436  0.00  0.00    +0.186 HD
ENDBRANCH  17  18
BRANCH  16  21
ATOM     21  N   LIG    1        3.134   1.456   0.543  0.00  0.00    -0.349 N 
ATOM     22  H   LIG    1        3.475   0.993   1.390  0.00  0.00    +0.146 HD
BRANCH  21  24
ATOM     23  C   LIG    1        5.232   1.365  -0.713  0.00  0.00    +0.024 C 
ATOM     24  C   LIG    1        4.142   2.254  -0.139  0.00  0.00    +0.097 C 
ENDBRANCH  21  24
ENDBRANCH  16  21
ENDBRANCH   1  17
TORSDOF 4