REMARK  Name = BDB014665
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.405  -0.367  -1.429  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1       -0.371  -1.580  -1.231  0.00  0.00    +0.251 C 
ATOM      3  N   LIG    1        0.715  -2.358  -1.568  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1        0.645  -3.370  -1.541  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        1.875  -1.825  -2.265  0.00  0.00    +0.136 C 
BRANCH   5   6
ATOM      6  C   LIG    1        3.175  -2.487  -1.794  0.00  0.00    +0.145 C 
BRANCH   6   7
ATOM      7  O   LIG    1        3.056  -3.901  -2.059  0.00  0.00    -0.389 OA
ATOM      8  H   LIG    1        3.931  -4.300  -1.888  0.00  0.00    +0.210 HD
ENDBRANCH   6   7
BRANCH   6   9
ATOM      9  C   LIG    1        3.515  -2.290  -0.292  0.00  0.00    +0.117 C 
BRANCH   9  10
ATOM     10  N   LIG    1        3.853  -0.969   0.241  0.00  0.00    -0.295 NA
ATOM     11  C   LIG    1        2.681  -0.184   0.661  0.00  0.00    +0.120 C 
ATOM     12  C   LIG    1        3.038   1.180   1.219  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1        4.291   1.764   0.964  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1        4.583   3.036   1.475  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        3.627   3.736   2.209  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        2.376   3.170   2.441  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        5.337   0.996   0.198  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1        2.080   1.900   1.946  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1        4.744  -0.172  -0.603  0.00  0.00    +0.089 C 
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   5   6
ENDBRANCH   3   5
BRANCH   2  20
ATOM     20  C   LIG    1       -1.518  -2.344  -0.571  0.00  0.00    +0.324 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.826  -1.732   0.684  0.00  0.00    -0.482 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -3.179  -1.756   0.914  0.00  0.00    +0.125 A 
ATOM     23  C   LIG    1       -3.927  -0.575   0.769  0.00  0.00    -0.001 A 
ATOM     24  C   LIG    1       -5.317  -0.657   0.964  0.00  0.00    +0.007 A 
ATOM     25  C   LIG    1       -5.921  -1.859   1.350  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -5.151  -3.002   1.540  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -3.775  -2.953   1.322  0.00  0.00    +0.046 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -3.256   0.723   0.347  0.00  0.00    +0.036 C 
ATOM     29  C   LIG    1       -3.452   0.988  -1.157  0.00  0.00    +0.089 C 
ATOM     30  N   LIG    1       -2.623   2.095  -1.661  0.00  0.00    -0.315 NA
ATOM     31  H   LIG    1       -1.716   1.700  -1.942  0.00  0.00    +0.122 HD
ATOM     32  C   LIG    1       -2.361   3.135  -0.657  0.00  0.00    +0.081 C 
ATOM     33  C   LIG    1       -3.476   3.265   0.379  0.00  0.00    +0.016 C 
ATOM     34  C   LIG    1       -3.672   1.964   1.167  0.00  0.00    +0.011 C 
ENDBRANCH  23  28
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 9