REMARK  Name = BDB059427
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.950  -1.217   0.389  0.00  0.00    +0.018 A 
ATOM      2  C   LIG    1        1.159  -2.026  -0.441  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1       -0.236  -2.078  -0.292  0.00  0.00    -0.008 A 
ATOM      4  C   LIG    1       -1.043  -2.962  -1.200  0.00  0.00    +0.047 C 
ATOM      5  C   LIG    1       -0.842  -1.264   0.677  0.00  0.00    +0.126 A 
ATOM      6  C   LIG    1       -0.073  -0.481   1.551  0.00  0.00    -0.008 A 
ATOM      7  C   LIG    1       -0.704   0.352   2.630  0.00  0.00    +0.047 C 
ATOM      8  C   LIG    1        1.319  -0.448   1.378  0.00  0.00    +0.018 A 
ENDROOT
BRANCH   1  15
ATOM      9  C   LIG    1        7.113   1.885   0.141  0.00  0.00    +0.127 A 
ATOM     10  C   LIG    1        5.753   1.606   0.260  0.00  0.00    +0.092 A 
ATOM     11  C   LIG    1        5.293   0.292   0.178  0.00  0.00    +0.146 A 
ATOM     12  C   LIG    1        6.187  -0.762  -0.024  0.00  0.00    +0.106 A 
ATOM     13  C   LIG    1        5.619  -2.131  -0.098  0.00  0.00    +0.197 A 
ATOM     14  C   LIG    1        4.157  -2.249   0.049  0.00  0.00    +0.098 A 
ATOM     15  C   LIG    1        3.416  -1.150   0.230  0.00  0.00    +0.139 A 
ATOM     16  O   LIG    1        6.273  -3.150  -0.272  0.00  0.00    -0.287 OA
ATOM     17  C   LIG    1        7.564  -0.493  -0.145  0.00  0.00    +0.138 A 
ATOM     18  O   LIG    1        3.937   0.127   0.309  0.00  0.00    -0.454 OA
ATOM     19  C   LIG    1        8.013   0.836  -0.061  0.00  0.00    +0.092 A 
BRANCH   9  21
ATOM     20  C   LIG    1        8.802   3.566   0.125  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1        7.429   3.212   0.240  0.00  0.00    -0.495 OA
ENDBRANCH   9  21
BRANCH  17  22
ATOM     22  O   LIG    1        8.399  -1.559  -0.343  0.00  0.00    -0.494 OA
ATOM     23  C   LIG    1        9.795  -1.328  -0.455  0.00  0.00    +0.277 C 
ENDBRANCH  17  22
ENDBRANCH   1  15
BRANCH   5  24
ATOM     24  O   LIG    1       -2.207  -1.292   0.823  0.00  0.00    -0.489 OA
BRANCH  24  25
ATOM     25  C   LIG    1       -2.818  -0.283  -0.005  0.00  0.00    +0.261 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -4.338  -0.404   0.170  0.00  0.00    +0.166 C 
BRANCH  26  27
ATOM     27  O   LIG    1       -4.730  -1.718  -0.262  0.00  0.00    -0.387 OA
ATOM     28  H   LIG    1       -4.180  -2.336   0.256  0.00  0.00    +0.210 HD
ENDBRANCH  26  27
BRANCH  26  29
ATOM     29  C   LIG    1       -5.069   0.679  -0.656  0.00  0.00    +0.119 C 
BRANCH  29  30
ATOM     30  N   LIG    1       -6.468   0.921  -0.245  0.00  0.00    -0.300 NA
ATOM     31  C   LIG    1       -7.041   2.072  -0.945  0.00  0.00    +0.084 C 
ATOM     32  C   LIG    1       -8.364   2.486  -0.290  0.00  0.00    +0.015 C 
ATOM     33  C   LIG    1       -9.199   1.297   0.189  0.00  0.00    +0.002 C 
ATOM     34  C   LIG    1       -8.811   0.028  -0.554  0.00  0.00    +0.015 C 
ATOM     35  C   LIG    1       -7.312  -0.278  -0.402  0.00  0.00    +0.084 C 
ENDBRANCH  29  30
ENDBRANCH  26  29
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH   5  24
TORSDOF 9