REMARK  Name = BDB015224
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.882  -1.189   0.306  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        2.510  -0.980   0.081  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1        1.563  -1.917   0.506  0.00  0.00    +0.122 A 
ATOM      4  C   LIG    1        1.992  -3.074   1.155  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        3.349  -3.293   1.382  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1        4.290  -2.353   0.958  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1        6.144  -0.141  -0.026  0.00  0.00    +0.266 C 
ATOM      8  N   LIG    1        4.767  -0.191  -0.161  0.00  0.00    -0.280 N 
ATOM      9  H   LIG    1        4.330   0.592  -0.624  0.00  0.00    +0.155 HD
ATOM     10  O   LIG    1        6.813  -0.976   0.574  0.00  0.00    -0.268 OA
BRANCH   7  13
ATOM     11  C   LIG    1        9.107   0.701   0.256  0.00  0.00    +0.150 C 
ATOM     12  N   LIG    1        8.093   1.380  -0.517  0.00  0.00    -0.330 N 
ATOM     13  C   LIG    1        6.766   1.017  -0.648  0.00  0.00    +0.124 A 
ATOM     14  C   LIG    1        6.256   1.992  -1.492  0.00  0.00    +0.143 A 
ATOM     15  N   LIG    1        7.206   2.913  -1.842  0.00  0.00    -0.243 NA
ATOM     16  C   LIG    1        8.302   2.518  -1.242  0.00  0.00    +0.199 A 
ENDBRANCH   7  13
ENDBRANCH   1   8
BRANCH   3  17
ATOM     17  O   LIG    1        0.208  -1.826   0.345  0.00  0.00    -0.489 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -0.304  -0.625  -0.247  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.836  -0.750  -0.288  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -2.171  -1.857  -1.137  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1       -1.647  -2.614  -0.812  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -2.465   0.557  -0.827  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.926   0.727  -0.755  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -4.428   0.809   0.625  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -5.933   0.968   0.706  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -6.755   0.597  -0.374  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -8.146   0.721  -0.266  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -8.721   1.187   0.916  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -7.912   1.537   1.995  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -6.133   0.129  -1.667  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -6.525   1.425   1.893  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -4.668  -0.300  -1.497  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 8