REMARK  Name = BDB063153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.736  -3.248   1.291  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1       -0.939  -2.386   0.943  0.00  0.00    +0.267 C 
ATOM      3  N   LIG    1       -1.229  -1.132   0.445  0.00  0.00    -0.280 N 
ATOM      4  H   LIG    1       -0.403  -0.588   0.206  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1       -2.486  -0.542   0.227  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -2.487   0.757  -0.311  0.00  0.00    +0.035 A 
ATOM      7  C   LIG    1       -3.713   1.403  -0.552  0.00  0.00    +0.021 A 
ATOM      8  C   LIG    1       -4.898   0.743  -0.254  0.00  0.00    +0.066 A 
ATOM      9  N   LIG    1       -5.896   1.618  -0.594  0.00  0.00    -0.277 N 
ATOM     10  H   LIG    1       -6.896   1.475  -0.515  0.00  0.00    +0.189 HD
ATOM     11  N   LIG    1       -5.454   2.789  -1.088  0.00  0.00    -0.181 NA
ATOM     12  C   LIG    1       -4.931  -0.546   0.280  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1       -4.126   2.654  -1.062  0.00  0.00    +0.142 A 
ATOM     14  C   LIG    1       -3.699  -1.175   0.514  0.00  0.00    +0.025 A 
ENDBRANCH   3   5
BRANCH   2  15
ATOM     15  C   LIG    1        0.512  -2.602   1.013  0.00  0.00    +0.135 A 
ATOM     16  N   LIG    1        1.408  -1.592   0.649  0.00  0.00    -0.220 NA
ATOM     17  C   LIG    1        2.653  -1.996   0.781  0.00  0.00    +0.163 A 
ATOM     18  S   LIG    1        2.810  -3.628   1.339  0.00  0.00    -0.060 S 
ATOM     19  C   LIG    1        1.110  -3.776   1.423  0.00  0.00    +0.081 A 
BRANCH  17  20
ATOM     20  N   LIG    1        3.779  -1.298   0.509  0.00  0.00    -0.294 N 
ATOM     21  H   LIG    1        4.654  -1.797   0.612  0.00  0.00    +0.154 HD
BRANCH  20  22
ATOM     22  C   LIG    1        3.932   0.064   0.192  0.00  0.00    +0.033 A 
ATOM     23  C   LIG    1        2.902   1.009   0.272  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1        3.113   2.345  -0.090  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        4.359   2.757  -0.552  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        5.394   1.833  -0.652  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        5.179   0.501  -0.287  0.00  0.00    +0.023 A 
ENDBRANCH  20  22
ENDBRANCH  17  20
ENDBRANCH   2  15
TORSDOF 4