REMARK  Name = BDB015390
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.256   1.242  -1.215  0.00  0.00    -0.172 N 
ATOM      2  C   LIG    1       -0.216   0.455  -1.710  0.00  0.00    +0.201 C 
ATOM      3  N   LIG    1       -0.456  -0.075  -2.868  0.00  0.00    -0.253 NA
ATOM      4  C   LIG    1       -1.820   0.368  -3.260  0.00  0.00    +0.166 C 
ATOM      5  C   LIG    1       -2.266   1.429  -2.253  0.00  0.00    +0.158 C 
ENDROOT
BRANCH   2   6
ATOM      6  N   LIG    1        0.920   0.310  -0.973  0.00  0.00    -0.300 N 
ATOM      7  C   LIG    1        1.649  -0.972  -1.067  0.00  0.00    +0.123 C 
ATOM      8  C   LIG    1        3.061  -0.803  -1.661  0.00  0.00    +0.103 C 
ATOM      9  N   LIG    1        3.921   0.143  -0.921  0.00  0.00    -0.296 NA
ATOM     10  C   LIG    1        3.138   1.150  -0.182  0.00  0.00    +0.103 C 
ATOM     11  C   LIG    1        1.811   1.491  -0.888  0.00  0.00    +0.123 C 
BRANCH   9  12
ATOM     12  C   LIG    1        4.992  -0.554  -0.203  0.00  0.00    +0.057 C 
ATOM     13  C   LIG    1        4.524  -1.361   1.029  0.00  0.00    +0.019 C 
ATOM     14  C   LIG    1        5.830  -0.888   1.714  0.00  0.00    +0.003 C 
ATOM     15  C   LIG    1        5.798   0.338   0.768  0.00  0.00    +0.019 C 
ENDBRANCH   9  12
ENDBRANCH   2   6
BRANCH   1  16
ATOM     16  S   LIG    1       -1.534   1.897   0.291  0.00  0.00    +0.077 S 
ATOM     17  O   LIG    1       -0.482   1.593   1.236  0.00  0.00    -0.150 OA
ATOM     18  O   LIG    1       -1.924   3.278   0.071  0.00  0.00    -0.150 OA
BRANCH  16  24
ATOM     19  C   LIG    1       -6.628  -0.895   2.161  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1       -5.372  -0.228   1.682  0.00  0.00    -0.050 A 
ATOM     21  C   LIG    1       -4.198  -0.973   1.503  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1       -2.993  -0.369   1.093  0.00  0.00    -0.024 A 
ATOM     23  C   LIG    1       -1.791  -1.251   0.905  0.00  0.00    +0.046 C 
ATOM     24  C   LIG    1       -2.996   1.018   0.851  0.00  0.00    +0.112 A 
ATOM     25  C   LIG    1       -4.164   1.772   1.053  0.00  0.00    +0.029 A 
ATOM     26  C   LIG    1       -5.341   1.152   1.470  0.00  0.00    +0.005 A 
ENDBRANCH  16  24
ENDBRANCH   1  16
TORSDOF 4