REMARK  Name = BDB014667
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.504   3.389  -0.188  0.00  0.00    -0.272 OA
ATOM      2  C   LIG    1       -0.726   3.126   0.725  0.00  0.00    +0.251 C 
ATOM      3  N   LIG    1        0.604   2.813   0.512  0.00  0.00    -0.310 N 
ATOM      4  H   LIG    1        1.204   2.645   1.308  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        1.228   2.933  -0.795  0.00  0.00    +0.136 C 
BRANCH   5   6
ATOM      6  C   LIG    1        0.720   1.972  -1.881  0.00  0.00    +0.145 C 
BRANCH   6   7
ATOM      7  O   LIG    1        1.601   2.065  -3.017  0.00  0.00    -0.389 OA
ATOM      8  H   LIG    1        2.191   1.285  -2.938  0.00  0.00    +0.210 HD
ENDBRANCH   6   7
BRANCH   6   9
ATOM      9  C   LIG    1        0.605   0.483  -1.480  0.00  0.00    +0.117 C 
BRANCH   9  10
ATOM     10  N   LIG    1        1.889  -0.257  -1.557  0.00  0.00    -0.295 NA
ATOM     11  C   LIG    1        2.638  -0.160  -0.285  0.00  0.00    +0.120 C 
ATOM     12  C   LIG    1        3.837  -1.080  -0.196  0.00  0.00    -0.030 A 
ATOM     13  C   LIG    1        3.952  -2.204  -1.032  0.00  0.00    -0.042 A 
ATOM     14  C   LIG    1        5.059  -3.054  -0.914  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        6.040  -2.802   0.044  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        5.920  -1.704   0.891  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        2.922  -2.447  -2.100  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1        4.822  -0.850   0.777  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1        1.619  -1.683  -1.837  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       -1.158   3.103   2.198  0.00  0.00    +0.324 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -2.036   2.046   2.563  0.00  0.00    -0.482 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -1.472   0.804   2.440  0.00  0.00    +0.125 A 
ATOM     23  C   LIG    1       -2.092  -0.137   1.602  0.00  0.00    -0.001 A 
ATOM     24  C   LIG    1       -1.503  -1.410   1.486  0.00  0.00    +0.007 A 
ATOM     25  C   LIG    1       -0.354  -1.741   2.206  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        0.219  -0.810   3.067  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1       -0.343   0.458   3.190  0.00  0.00    +0.046 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -3.358   0.203   0.826  0.00  0.00    +0.036 C 
ATOM     29  C   LIG    1       -3.143   0.148  -0.699  0.00  0.00    +0.089 C 
ATOM     30  N   LIG    1       -4.304   0.597  -1.480  0.00  0.00    -0.315 NA
ATOM     31  H   LIG    1       -4.215   1.600  -1.650  0.00  0.00    +0.122 HD
ATOM     32  C   LIG    1       -5.589   0.357  -0.819  0.00  0.00    +0.081 C 
ATOM     33  C   LIG    1       -5.567  -0.853   0.109  0.00  0.00    +0.016 C 
ATOM     34  C   LIG    1       -4.554  -0.679   1.242  0.00  0.00    +0.011 C 
ENDBRANCH  23  28
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 9