REMARK  Name = BDB002380
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.247   0.274  -0.292  0.00  0.00    +0.237 C 
ATOM      2  N   LIG    1       -0.110   0.750  -0.910  0.00  0.00    -0.288 N 
ATOM      3  C   LIG    1        1.210   0.568  -0.289  0.00  0.00    +0.162 C 
ATOM      4  C   LIG    1        2.187   0.735  -1.457  0.00  0.00    +0.033 C 
ATOM      5  C   LIG    1        1.446   1.655  -2.418  0.00  0.00    +0.021 C 
ATOM      6  C   LIG    1        0.009   1.183  -2.289  0.00  0.00    +0.109 C 
ATOM      7  O   LIG    1       -1.205  -0.258   0.827  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        1.462   1.633   0.799  0.00  0.00    +0.239 C 
ATOM      9  N   LIG    1        2.522   1.547   1.655  0.00  0.00    -0.268 N 
ATOM     10  H   LIG    1        2.535   2.318   2.304  0.00  0.00    +0.156 HD
ATOM     11  O   LIG    1        0.757   2.643   0.899  0.00  0.00    -0.273 OA
BRANCH   9  12
ATOM     12  C   LIG    1        3.532   0.578   1.767  0.00  0.00    +0.133 A 
ATOM     13  C   LIG    1        4.580   0.768   2.711  0.00  0.00    +0.022 A 
ATOM     14  C   LIG    1        5.591  -0.225   2.761  0.00  0.00    -0.013 A 
ATOM     15  C   LIG    1        6.673  -0.100   3.653  0.00  0.00    +0.008 A 
ATOM     16  C   LIG    1        6.774   0.996   4.506  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        5.798   1.985   4.474  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        5.517  -1.327   1.909  0.00  0.00    +0.028 A 
ATOM     19  C   LIG    1        4.454  -1.416   1.035  0.00  0.00    +0.113 A 
ATOM     20  C   LIG    1        4.718   1.875   3.591  0.00  0.00    +0.012 A 
ATOM     21  N   LIG    1        3.477  -0.491   0.948  0.00  0.00    -0.239 NA
ENDBRANCH   9  12
ENDBRANCH   3   8
BRANCH   1  22
ATOM     22  C   LIG    1       -2.598   0.440  -1.042  0.00  0.00    +0.162 C 
BRANCH  22  24
ATOM     23  C   LIG    1       -2.988  -1.911  -1.705  0.00  0.00    +0.230 C 
ATOM     24  N   LIG    1       -3.329  -0.821  -0.926  0.00  0.00    -0.302 N 
ATOM     25  H   LIG    1       -3.770  -1.041  -0.042  0.00  0.00    +0.150 HD
ATOM     26  O   LIG    1       -2.181  -1.847  -2.634  0.00  0.00    -0.274 OA
BRANCH  23  27
ATOM     27  C   LIG    1       -3.696  -3.214  -1.274  0.00  0.00    +0.137 C 
ATOM     28  C   LIG    1       -3.276  -4.410  -2.129  0.00  0.00    +0.034 C 
BRANCH  27  30
ATOM     29  C   LIG    1       -5.783  -2.558  -2.424  0.00  0.00    +0.101 C 
ATOM     30  N   LIG    1       -5.170  -3.052  -1.198  0.00  0.00    -0.309 NA
ATOM     31  H   LIG    1       -5.600  -3.946  -0.959  0.00  0.00    +0.122 HD
ENDBRANCH  27  30
ENDBRANCH  23  27
ENDBRANCH  22  24
BRANCH  22  32
ATOM     32  C   LIG    1       -3.451   1.620  -0.507  0.00  0.00    +0.012 C 
ATOM     33  C   LIG    1       -3.714   1.582   1.007  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1       -2.844   2.973  -0.884  0.00  0.00    +0.009 C 
ENDBRANCH  22  32
ENDBRANCH   1  22
TORSDOF 7