REMARK  Name = BDB033428
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  S   UNK    1        0.585  -2.307  -2.162  0.00  0.00    +0.096 S 
ATOM      2  O   UNK    1        0.052  -2.164  -3.500  0.00  0.00    -0.148 OA
ATOM      3  O   UNK    1        1.612  -3.290  -1.879  0.00  0.00    -0.148 OA
ENDROOT
BRANCH   1   4
ATOM      4  C   UNK    1        1.279  -0.737  -1.661  0.00  0.00    +0.236 A 
ATOM      5  S   UNK    1        1.173   0.583  -2.740  0.00  0.00    -0.055 S 
ATOM      6  C   UNK    1        1.933   1.582  -1.575  0.00  0.00    +0.081 A 
ATOM      7  C   UNK    1        2.233   0.852  -0.438  0.00  0.00    +0.135 A 
ATOM      8  N   UNK    1        1.826  -0.488  -0.480  0.00  0.00    -0.216 NA
BRANCH   7   9
ATOM      9  C   UNK    1        2.906   1.409   0.739  0.00  0.00    +0.263 C 
ATOM     10  N   UNK    1        3.224   0.448   1.674  0.00  0.00    -0.308 N 
ATOM     11  H   UNK    1        2.844  -0.478   1.500  0.00  0.00    +0.149 HD
ATOM     12  O   UNK    1        3.144   2.603   0.872  0.00  0.00    -0.269 OA
BRANCH  10  13
ATOM     13  C   UNK    1        3.706   0.799   2.999  0.00  0.00    +0.132 C 
BRANCH  13  14
ATOM     14  C   UNK    1        4.486  -0.352   3.627  0.00  0.00    +0.174 C 
BRANCH  14  15
ATOM     15  O   UNK    1        5.659  -0.635   2.869  0.00  0.00    -0.393 OA
ATOM     16  H   UNK    1        5.422  -0.549   1.928  0.00  0.00    +0.209 HD
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH  10  13
ENDBRANCH   7   9
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  N   UNK    1       -0.720  -2.681  -1.112  0.00  0.00    -0.212 N 
ATOM     18  H   UNK    1       -1.010  -3.632  -1.348  0.00  0.00    +0.174 HD
BRANCH  17  26
ATOM     19  C   UNK    1       -4.979   1.210  -1.433  0.00  0.00    +0.044 C 
ATOM     20  C   UNK    1       -3.862   0.209  -1.293  0.00  0.00    -0.040 A 
ATOM     21  C   UNK    1       -2.855   0.300  -0.294  0.00  0.00    +0.022 A 
ATOM     22  C   UNK    1       -1.857  -0.679  -0.251  0.00  0.00    +0.071 A 
ATOM     23  N   UNK    1       -1.023  -0.375   0.803  0.00  0.00    -0.358 N 
ATOM     24  H   UNK    1       -0.211  -0.926   1.055  0.00  0.00    +0.165 HD
ATOM     25  C   UNK    1       -1.431   0.776   1.416  0.00  0.00    +0.102 A 
ATOM     26  C   UNK    1       -1.806  -1.751  -1.149  0.00  0.00    +0.072 A 
ATOM     27  C   UNK    1       -2.786  -1.825  -2.136  0.00  0.00    +0.027 A 
ATOM     28  C   UNK    1       -2.566   1.216   0.768  0.00  0.00    +0.077 A 
ATOM     29  C   UNK    1       -3.796  -0.868  -2.203  0.00  0.00    +0.006 A 
BRANCH  28  30
ATOM     30  C   UNK    1       -3.292   2.393   1.129  0.00  0.00    +0.101 C 
ATOM     31  N   UNK    1       -3.883   3.348   1.423  0.00  0.00    -0.191 NA
ENDBRANCH  28  30
ENDBRANCH  17  26
ENDBRANCH   1  17
TORSDOF 8