REMARK  Name = BDB021633
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.186  -0.293  -0.319  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1        4.428   0.051   0.803  0.00  0.00    +0.055 A 
ATOM      3  C   LIG    1        3.036  -0.181   0.871  0.00  0.00    +0.133 A 
ATOM      4  O   LIG    1        2.545   0.241   2.072  0.00  0.00    -0.490 OA
ATOM      5  C   LIG    1        1.303  -0.288   2.496  0.00  0.00    +0.248 C 
ATOM      6  C   LIG    1        0.186   0.255   1.634  0.00  0.00    +0.149 C 
ATOM      7  N   LIG    1       -0.075  -0.633   0.514  0.00  0.00    -0.292 N 
ATOM      8  C   LIG    1        0.901  -1.032  -0.399  0.00  0.00    +0.250 C 
ATOM      9  O   LIG    1        0.557  -1.642  -1.417  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1        2.368  -0.747  -0.222  0.00  0.00    +0.078 A 
ATOM     11  C   LIG    1        3.156  -1.090  -1.350  0.00  0.00    +0.017 A 
ATOM     12  C   LIG    1        4.537  -0.872  -1.401  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  15
ATOM     13  C   LIG    1        7.673  -2.283  -1.234  0.00  0.00    +0.068 C 
ATOM     14  C   LIG    1        7.703  -0.879  -0.754  0.00  0.00    +0.068 A 
ATOM     15  C   LIG    1        6.615  -0.053  -0.355  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        7.205   1.137   0.017  0.00  0.00    +0.116 A 
ATOM     17  N   LIG    1        8.544   0.975  -0.177  0.00  0.00    -0.274 N 
ATOM     18  C   LIG    1        9.580   1.949   0.062  0.00  0.00    +0.172 C 
ATOM     19  N   LIG    1        8.876  -0.239  -0.646  0.00  0.00    -0.176 NA
ENDBRANCH   1  15
BRANCH   7  20
ATOM     20  C   LIG    1       -1.483  -0.799   0.111  0.00  0.00    +0.140 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -1.994   0.390  -0.727  0.00  0.00    +0.146 C 
BRANCH  21  22
ATOM     22  O   LIG    1       -2.258   1.516   0.121  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1       -2.974   1.253   0.723  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1       -3.219   0.052  -1.618  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -4.568  -0.099  -1.054  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1       -5.280   1.170  -0.858  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1       -6.671   1.012  -0.274  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1       -7.088  -0.200   0.304  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1       -8.374  -0.305   0.850  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -9.233   0.793   0.848  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -8.818   2.001   0.293  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -6.177  -1.399   0.274  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1       -7.543   2.111  -0.264  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1       -4.707  -1.008   0.076  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   7  20
TORSDOF 6