REMARK  Name = BDB000143
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.203   0.226  -1.470  0.00  0.00    +0.237 C 
ATOM      2  N   LIG    1       -0.146  -0.084  -2.297  0.00  0.00    -0.288 N 
ATOM      3  C   LIG    1        0.575  -1.362  -2.424  0.00  0.00    +0.162 C 
ATOM      4  C   LIG    1        1.176  -1.292  -3.830  0.00  0.00    +0.033 C 
ATOM      5  C   LIG    1        1.451   0.197  -4.017  0.00  0.00    +0.021 C 
ATOM      6  C   LIG    1        0.262   0.852  -3.334  0.00  0.00    +0.109 C 
ATOM      7  O   LIG    1       -1.727   1.345  -1.512  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        1.708  -1.547  -1.389  0.00  0.00    +0.234 C 
ATOM      9  N   LIG    1        1.973  -0.441  -0.614  0.00  0.00    -0.310 N 
ATOM     10  H   LIG    1        1.258   0.275  -0.578  0.00  0.00    +0.149 HD
ATOM     11  O   LIG    1        2.358  -2.587  -1.321  0.00  0.00    -0.274 OA
BRANCH   9  12
ATOM     12  C   LIG    1        2.906  -0.515   0.484  0.00  0.00    +0.139 C 
BRANCH  12  13
ATOM     13  C   LIG    1        2.945   0.778   1.256  0.00  0.00    -0.030 A 
ATOM     14  C   LIG    1        3.253   1.989   0.618  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1        3.280   3.184   1.339  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        3.010   3.181   2.706  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        2.716   1.983   3.354  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        2.684   0.788   2.633  0.00  0.00    +0.005 A 
ENDBRANCH  12  13
ENDBRANCH   9  12
ENDBRANCH   3   8
BRANCH   1  19
ATOM     19  C   LIG    1       -1.715  -0.834  -0.469  0.00  0.00    +0.162 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -1.792  -0.128   0.809  0.00  0.00    -0.302 N 
ATOM     21  H   LIG    1       -2.173   0.820   0.794  0.00  0.00    +0.150 HD
ATOM     22  C   LIG    1       -0.920  -0.368   1.847  0.00  0.00    +0.230 C 
ATOM     23  O   LIG    1       -0.124  -1.301   1.866  0.00  0.00    -0.274 OA
BRANCH  22  24
ATOM     24  C   LIG    1       -1.066   0.626   3.014  0.00  0.00    +0.135 C 
ATOM     25  C   LIG    1       -2.332   0.331   3.806  0.00  0.00    +0.033 C 
BRANCH  24  26
ATOM     26  N   LIG    1       -1.118   2.002   2.477  0.00  0.00    -0.320 NA
ATOM     27  H   LIG    1       -0.217   2.206   2.035  0.00  0.00    +0.119 HD
ATOM     28  H   LIG    1       -1.187   2.657   3.256  0.00  0.00    +0.119 HD
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH  19  20
BRANCH  19  30
ATOM     29  C   LIG    1       -3.080  -2.053  -2.248  0.00  0.00    +0.009 C 
ATOM     30  C   LIG    1       -3.111  -1.349  -0.887  0.00  0.00    +0.012 C 
ATOM     31  C   LIG    1       -3.683  -2.313   0.160  0.00  0.00    +0.009 C 
ENDBRANCH  19  30
ENDBRANCH   1  19
TORSDOF 8