REMARK  Name = BDB032752
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.835   0.876   1.849  0.00  0.00    -0.010 A 
ATOM      2  C   LIG    1        1.807   0.934   0.840  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1        2.985   0.238   1.042  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1        4.157   0.135   0.166  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1        5.045  -0.729   0.784  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        4.596  -1.112   2.116  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1        4.294   0.739  -0.878  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        3.236  -0.506   2.191  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        2.287  -0.581   3.193  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        1.080   0.109   3.013  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        6.406  -1.006   0.339  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        7.268   0.252   0.458  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        7.480   0.801   1.539  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        7.763   0.783  -0.705  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        8.316   1.622  -0.606  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        7.501   0.405  -1.996  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        7.995   1.021  -2.938  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        6.575  -0.766  -2.204  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.531  -1.705  -1.012  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1       -0.480   1.595   1.675  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.334   0.751   0.899  0.00  0.00    -0.445 OA
BRANCH  21  24
ATOM     22  N   LIG    1       -3.283   0.374  -0.056  0.00  0.00    -0.251 N 
ATOM     23  H   LIG    1       -2.751  -0.448  -0.308  0.00  0.00    +0.158 HD
ATOM     24  C   LIG    1       -2.576   1.264   0.702  0.00  0.00    +0.405 C 
ATOM     25  O   LIG    1       -2.949   2.337   1.148  0.00  0.00    -0.226 OA
BRANCH  22  31
ATOM     26  C   LIG    1       -6.416  -0.517  -1.743  0.00  0.00    +0.043 A 
ATOM     27  N   LIG    1       -7.234   0.525  -1.474  0.00  0.00    -0.257 NA
ATOM     28  C   LIG    1       -6.742   1.543  -0.731  0.00  0.00    +0.040 A 
ATOM     29  C   LIG    1       -7.663   2.692  -0.446  0.00  0.00    +0.065 C 
ATOM     30  C   LIG    1       -5.443   1.553  -0.234  0.00  0.00    +0.046 A 
ATOM     31  C   LIG    1       -4.610   0.474  -0.509  0.00  0.00    +0.040 A 
ATOM     32  C   LIG    1       -5.107  -0.579  -1.276  0.00  0.00    +0.046 A 
BRANCH  26  34
ATOM     33  C   LIG    1       -7.595  -2.724  -1.664  0.00  0.00    +0.010 C 
ATOM     34  C   LIG    1       -6.996  -1.646  -2.554  0.00  0.00    +0.052 C 
ENDBRANCH  26  34
ENDBRANCH  22  31
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 6