REMARK  Name = BDB056267
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.100  -0.690  -0.372  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.561  -0.552  -1.657  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1       -0.617   0.172  -1.835  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1       -1.251   0.737  -0.722  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -0.721   0.595   0.565  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        0.454  -0.137   0.742  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        2.278  -2.674  -0.551  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.326  -1.498  -0.198  0.00  0.00    +0.247 C 
ATOM      9  N   LIG    1        3.456  -0.897   0.367  0.00  0.00    -0.297 N 
ATOM     10  C   LIG    1        3.684   0.554   0.317  0.00  0.00    +0.113 C 
ATOM     11  C   LIG    1        4.830   1.006   1.242  0.00  0.00    +0.024 C 
ATOM     12  C   LIG    1        6.145   0.276   0.896  0.00  0.00    +0.066 C 
ATOM     13  C   LIG    1        5.739  -1.139   1.360  0.00  0.00    +0.024 C 
ATOM     14  C   LIG    1        5.166  -0.870   2.765  0.00  0.00    +0.007 C 
ATOM     15  C   LIG    1        4.568   0.541   2.687  0.00  0.00    +0.007 C 
ATOM     16  C   LIG    1        4.656  -1.732   0.443  0.00  0.00    +0.113 C 
BRANCH  12  17
ATOM     17  N   LIG    1        6.577   0.401  -0.507  0.00  0.00    -0.299 NA
ATOM     18  C   LIG    1        7.787  -0.380  -0.812  0.00  0.00    +0.085 C 
ATOM     19  C   LIG    1        8.963   0.491  -0.399  0.00  0.00    +0.017 C 
ATOM     20  C   LIG    1        8.430   1.915  -0.446  0.00  0.00    +0.017 C 
ATOM     21  C   LIG    1        6.972   1.776  -0.861  0.00  0.00    +0.085 C 
ENDBRANCH  12  17
ENDBRANCH   1   8
BRANCH   4  22
ATOM     22  C   LIG    1       -2.496   1.502  -0.911  0.00  0.00    +0.247 C 
ATOM     23  N   LIG    1       -3.688   0.789  -1.058  0.00  0.00    -0.297 N 
ATOM     24  C   LIG    1       -4.920   1.578  -1.109  0.00  0.00    +0.113 C 
ATOM     25  C   LIG    1       -6.122   0.779  -1.642  0.00  0.00    +0.024 C 
ATOM     26  C   LIG    1       -6.357  -0.492  -0.803  0.00  0.00    +0.066 C 
ATOM     27  C   LIG    1       -5.098  -1.278  -1.213  0.00  0.00    +0.024 C 
ATOM     28  C   LIG    1       -5.135  -1.161  -2.749  0.00  0.00    +0.007 C 
ATOM     29  C   LIG    1       -5.805   0.192  -3.031  0.00  0.00    +0.007 C 
ATOM     30  C   LIG    1       -3.824  -0.618  -0.657  0.00  0.00    +0.113 C 
ATOM     31  O   LIG    1       -2.406   2.727  -0.946  0.00  0.00    -0.270 OA
BRANCH  26  32
ATOM     32  N   LIG    1       -6.533  -0.282   0.634  0.00  0.00    -0.299 NA
ATOM     33  C   LIG    1       -6.709  -1.525   1.389  0.00  0.00    +0.085 C 
ATOM     34  C   LIG    1       -7.179  -1.024   2.746  0.00  0.00    +0.017 C 
ATOM     35  C   LIG    1       -7.923   0.272   2.450  0.00  0.00    +0.017 C 
ATOM     36  C   LIG    1       -7.716   0.521   0.961  0.00  0.00    +0.085 C 
ENDBRANCH  26  32
ENDBRANCH   4  22
TORSDOF 4