REMARK  Name = BDB025292
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.328  -0.132  -0.985  0.00  0.00    -0.313 N 
ATOM      2  C   LIG    1       -3.711   0.402  -2.193  0.00  0.00    +0.142 A 
ATOM      3  C   LIG    1       -2.662   1.174  -2.674  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1       -2.852   1.829  -3.904  0.00  0.00    +0.013 A 
ATOM      5  C   LIG    1       -4.075   1.658  -4.550  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1       -5.038   0.851  -3.961  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1       -1.599   1.076  -1.727  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -0.298   1.617  -1.671  0.00  0.00    +0.011 A 
ATOM      9  C   LIG    1        0.533   1.319  -0.587  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1        0.091   0.493   0.451  0.00  0.00    -0.045 A 
ATOM     11  C   LIG    1       -1.201  -0.057   0.409  0.00  0.00    +0.030 A 
ATOM     12  N   LIG    1       -4.906   0.194  -2.787  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1       -2.031   0.248  -0.684  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  20
ATOM     14  O   LIG    1       -7.665  -3.178   0.346  0.00  0.00    -0.275 OA
ATOM     15  C   LIG    1       -6.636  -2.555   0.103  0.00  0.00    +0.219 C 
ATOM     16  N   LIG    1       -6.630  -1.185   0.046  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1       -7.512  -0.740   0.259  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1       -5.527  -0.366   0.122  0.00  0.00    +0.242 C 
ATOM     19  O   LIG    1       -5.651   0.791   0.522  0.00  0.00    -0.273 OA
ATOM     20  C   LIG    1       -4.177  -1.009  -0.182  0.00  0.00    +0.176 C 
ATOM     21  C   LIG    1       -4.329  -2.387  -0.834  0.00  0.00    +0.044 C 
ATOM     22  C   LIG    1       -5.296  -3.238  -0.031  0.00  0.00    +0.099 C 
ENDBRANCH   1  20
BRANCH  10  23
ATOM     23  C   LIG    1        1.012   0.171   1.605  0.00  0.00    +0.037 C 
BRANCH  23  24
ATOM     24  C   LIG    1        1.805  -1.113   1.344  0.00  0.00    +0.033 C 
BRANCH  24  25
ATOM     25  C   LIG    1        2.717  -1.470   2.516  0.00  0.00    +0.160 C 
BRANCH  25  26
ATOM     26  O   LIG    1        3.622  -0.420   2.849  0.00  0.00    -0.377 OA
BRANCH  26  27
ATOM     27  C   LIG    1        4.731  -0.323   1.957  0.00  0.00    +0.188 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.699   0.740   2.474  0.00  0.00    +0.188 C 
BRANCH  28  29
ATOM     29  O   LIG    1        6.846   0.873   1.633  0.00  0.00    -0.375 OA
BRANCH  29  30
ATOM     30  C   LIG    1        6.619   1.750   0.521  0.00  0.00    +0.187 C 
BRANCH  30  31
ATOM     31  C   LIG    1        7.911   1.825  -0.286  0.00  0.00    +0.184 C 
BRANCH  31  32
ATOM     32  O   LIG    1        8.960   2.345   0.529  0.00  0.00    -0.393 OA
ATOM     33  H   LIG    1        8.907   1.840   1.365  0.00  0.00    +0.209 HD
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  10  23
TORSDOF 11