REMARK  Name = BDB025423
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.624   2.132   1.182  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1        5.745   0.835   0.421  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1        4.575   0.293  -0.101  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1        3.328   1.072  -0.197  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1        2.160   0.187  -0.445  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        2.268  -1.188  -0.707  0.00  0.00    +0.072 A 
ATOM      7  N   LIG    1        1.098  -1.766  -0.951  0.00  0.00    -0.167 NA
ATOM      8  N   LIG    1        0.166  -0.783  -0.723  0.00  0.00    -0.185 N 
ATOM      9  C   LIG    1       -1.197  -1.175  -0.654  0.00  0.00    +0.257 C 
ATOM     10  O   LIG    1       -1.519  -2.288  -1.067  0.00  0.00    -0.270 OA
ATOM     11  C   LIG    1        3.562  -1.911  -0.735  0.00  0.00    +0.076 C 
ATOM     12  C   LIG    1        0.813   0.463  -0.558  0.00  0.00    +0.128 A 
ATOM     13  C   LIG    1        4.698  -0.904  -0.959  0.00  0.00    +0.114 C 
ATOM     14  O   LIG    1        6.845   0.298   0.294  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   9  15
ATOM     15  C   LIG    1       -2.148  -0.194   0.016  0.00  0.00    +0.113 C 
ATOM     16  C   LIG    1       -3.626  -0.444  -0.295  0.00  0.00    -0.014 A 
ATOM     17  C   LIG    1       -4.597  -0.310   0.715  0.00  0.00    +0.031 A 
ATOM     18  C   LIG    1       -5.941  -0.564   0.407  0.00  0.00    +0.023 A 
ATOM     19  C   LIG    1       -6.338  -0.859  -0.897  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1       -5.389  -0.924  -1.909  0.00  0.00    +0.000 A 
ATOM     21  N   LIG    1       -4.250  -0.056   2.050  0.00  0.00    -0.344 N 
ATOM     22  H   LIG    1       -5.005   0.387   2.568  0.00  0.00    +0.146 HD
ATOM     23  C   LIG    1       -2.951   0.552   2.267  0.00  0.00    +0.102 C 
ATOM     24  C   LIG    1       -4.043  -0.714  -1.613  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1       -1.888  -0.240   1.529  0.00  0.00    +0.036 C 
ENDBRANCH   9  15
BRANCH  12  26
ATOM     26  N   LIG    1        0.207   1.682  -0.535  0.00  0.00    -0.343 N 
ATOM     27  H   LIG    1        0.808   2.506  -0.505  0.00  0.00    +0.144 HD
ATOM     28  H   LIG    1       -0.532   1.863  -1.217  0.00  0.00    +0.144 HD
ENDBRANCH  12  26
TORSDOF 2