REMARK  Name = BDB024693
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.316  -1.632   1.362  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        4.828  -0.654   0.477  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        5.815   0.317  -0.042  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        6.776  -0.343  -1.045  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        5.210   1.557  -0.720  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        3.952   2.003  -0.007  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        2.978   0.863  -0.063  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        1.608   1.060  -0.332  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1        0.933   2.228  -0.590  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1       -0.328   1.893  -0.790  0.00  0.00    +0.115 A 
ATOM     11  N   LIG    1       -0.492   0.531  -0.647  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1        0.741  -0.023  -0.373  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        1.172  -1.335  -0.163  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        2.534  -1.521   0.111  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        3.438  -0.451   0.185  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        6.511  -1.800   1.594  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1        4.842  -3.300   2.950  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1        4.350  -2.343   2.011  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1       -1.726  -0.230  -0.788  0.00  0.00    +0.139 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.320  -0.631   0.576  0.00  0.00    +0.106 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.537  -1.460   0.635  0.00  0.00    -0.299 NA
ATOM     22  C   LIG    1       -4.653  -0.931  -0.176  0.00  0.00    +0.097 C 
ATOM     23  C   LIG    1       -4.553  -2.153  -1.037  0.00  0.00    +0.043 C 
ATOM     24  C   LIG    1       -4.355  -2.020  -2.509  0.00  0.00    +0.171 C 
ATOM     25  O   LIG    1       -5.540  -2.831  -2.754  0.00  0.00    -0.378 OA
ATOM     26  C   LIG    1       -5.765  -2.975  -1.319  0.00  0.00    +0.171 C 
ATOM     27  C   LIG    1       -3.456  -2.694  -0.174  0.00  0.00    +0.097 C 
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  28
ATOM     28  C   LIG    1       -1.414   2.867  -1.142  0.00  0.00    +0.109 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -2.463   3.050  -0.069  0.00  0.00    -0.040 A 
ATOM     30  C   LIG    1       -2.097   3.329   1.257  0.00  0.00    +0.004 A 
ATOM     31  C   LIG    1       -3.071   3.501   2.242  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -4.420   3.411   1.910  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -4.798   3.161   0.592  0.00  0.00    +0.000 A 
ATOM     34  C   LIG    1       -3.826   2.988  -0.394  0.00  0.00    +0.004 A 
ENDBRANCH  28  29
ENDBRANCH  10  28
TORSDOF 6