REMARK  Name = BDB015341
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   LIG    1       -0.362  -1.968  -0.781  0.00  0.00    +0.077 S 
ATOM      2  O   LIG    1        0.079  -2.166   0.582  0.00  0.00    -0.150 OA
ATOM      3  O   LIG    1       -0.458  -3.077  -1.710  0.00  0.00    -0.150 OA
ENDROOT
BRANCH   1   7
ATOM      4  C   LIG    1       -4.526  -0.077  -0.435  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1       -3.434   0.451   0.274  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -2.168  -0.128   0.170  0.00  0.00    +0.029 A 
ATOM      7  C   LIG    1       -1.988  -1.240  -0.656  0.00  0.00    +0.109 A 
ATOM      8  C   LIG    1       -3.060  -1.786  -1.365  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1       -4.323  -1.200  -1.254  0.00  0.00    +0.010 A 
BRANCH   4  12
ATOM     10  C   LIG    1       -6.484  -0.987   1.623  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1       -6.796   0.117   0.647  0.00  0.00    -0.043 A 
ATOM     12  C   LIG    1       -5.856   0.534  -0.321  0.00  0.00    -0.015 A 
ATOM     13  C   LIG    1       -6.208   1.570  -1.205  0.00  0.00    +0.009 A 
ATOM     14  C   LIG    1       -7.460   2.182  -1.137  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -8.382   1.767  -0.183  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -8.054   0.742   0.703  0.00  0.00    +0.004 A 
ENDBRANCH   4  12
ENDBRANCH   1   7
BRANCH   1  17
ATOM     17  N   LIG    1        0.508  -0.720  -1.538  0.00  0.00    -0.172 N 
ATOM     18  C   LIG    1        1.921  -0.723  -1.581  0.00  0.00    +0.201 C 
ATOM     19  N   LIG    1        2.430  -0.615  -2.770  0.00  0.00    -0.253 NA
ATOM     20  C   LIG    1        1.294  -0.616  -3.718  0.00  0.00    +0.166 C 
ATOM     21  C   LIG    1        0.034  -0.377  -2.896  0.00  0.00    +0.158 C 
BRANCH  18  22
ATOM     22  N   LIG    1        2.634  -0.774  -0.418  0.00  0.00    -0.300 N 
ATOM     23  C   LIG    1        2.187  -0.092   0.807  0.00  0.00    +0.123 C 
ATOM     24  C   LIG    1        3.274   0.869   1.331  0.00  0.00    +0.103 C 
ATOM     25  N   LIG    1        4.520   0.176   1.720  0.00  0.00    -0.296 NA
ATOM     26  C   LIG    1        4.767  -1.010   0.876  0.00  0.00    +0.103 C 
ATOM     27  C   LIG    1        4.093  -0.973  -0.513  0.00  0.00    +0.123 C 
BRANCH  25  28
ATOM     28  C   LIG    1        5.597   1.158   1.883  0.00  0.00    +0.057 C 
ATOM     29  C   LIG    1        6.452   1.431   0.628  0.00  0.00    +0.019 C 
ATOM     30  C   LIG    1        7.677   1.433   1.575  0.00  0.00    +0.003 C 
ATOM     31  C   LIG    1        6.854   0.542   2.536  0.00  0.00    +0.019 C 
ENDBRANCH  25  28
ENDBRANCH  18  22
ENDBRANCH   1  17
TORSDOF 5