REMARK  Name = BDB014480
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.203   2.204   1.501  0.00  0.00    +0.254 C 
ATOM      2  N   LIG    1       -0.961   0.912   1.080  0.00  0.00    -0.310 N 
ATOM      3  H   LIG    1       -1.727   0.476   0.560  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1       -0.334   2.926   1.978  0.00  0.00    -0.272 OA
ENDROOT
BRANCH   1   6
ATOM      5  C   LIG    1       -2.902   4.038   1.847  0.00  0.00    +0.062 C 
ATOM      6  C   LIG    1       -2.675   2.616   1.347  0.00  0.00    +0.256 C 
BRANCH   6   7
ATOM      7  O   LIG    1       -2.986   2.562  -0.056  0.00  0.00    -0.478 OA
BRANCH   7   8
ATOM      8  C   LIG    1       -4.212   1.979  -0.293  0.00  0.00    +0.147 A 
ATOM      9  C   LIG    1       -4.384   0.588  -0.229  0.00  0.00    +0.112 A 
ATOM     10  C   LIG    1       -5.678   0.093  -0.509  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -5.893  -1.290  -0.441  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1       -4.847  -2.140  -0.113  0.00  0.00    +0.020 A 
ATOM     13  C   LIG    1       -3.613  -1.578   0.142  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1       -6.725   0.967  -0.855  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -6.506   2.339  -0.941  0.00  0.00    +0.004 A 
ATOM     16  N   LIG    1       -3.359  -0.248   0.087  0.00  0.00    -0.251 NA
ATOM     17  C   LIG    1       -5.242   2.846  -0.671  0.00  0.00    +0.048 A 
ENDBRANCH   7   8
ENDBRANCH   6   7
ENDBRANCH   1   6
BRANCH   2  18
ATOM     18  C   LIG    1        0.391   0.393   0.947  0.00  0.00    +0.136 C 
BRANCH  18  19
ATOM     19  C   LIG    1        0.397  -1.142   0.870  0.00  0.00    +0.145 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -0.216  -1.618  -0.338  0.00  0.00    -0.389 OA
ATOM     21  H   LIG    1       -0.799  -0.908  -0.666  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        1.817  -1.738   1.024  0.00  0.00    +0.117 C 
BRANCH  22  23
ATOM     23  N   LIG    1        2.885  -1.091   0.232  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        4.206  -1.548   0.713  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        5.370  -1.052  -0.118  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        5.177  -0.619  -1.440  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        6.273  -0.192  -2.200  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        7.559  -0.222  -1.660  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.757  -0.671  -0.357  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        3.784  -0.551  -2.011  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        6.669  -1.086   0.410  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        2.769  -1.378  -1.207  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   2  18
TORSDOF 8