REMARK  Name = BDB007765
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.509   1.905   0.386  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1        0.207   2.285   0.184  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1        0.113   3.292   0.123  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        2.404   2.740   0.455  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1        3.063  -1.458  -0.294  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        2.725  -0.106  -0.394  0.00  0.00    +0.036 A 
ATOM      7  C   LIG    1        1.832   0.473   0.517  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1        1.273  -0.276   1.554  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1        1.570  -1.629   1.645  0.00  0.00    +0.003 A 
ATOM     10  C   LIG    1        2.439  -2.213   0.716  0.00  0.00    +0.023 A 
BRANCH   5  11
ATOM     11  N   LIG    1        3.869  -2.136  -1.218  0.00  0.00    -0.339 N 
ATOM     12  H   LIG    1        4.265  -2.973  -0.791  0.00  0.00    +0.146 HD
BRANCH  11  17
ATOM     13  C   LIG    1        8.805  -3.904  -0.889  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1        8.079  -2.614  -0.609  0.00  0.00    +0.213 C 
ATOM     15  N   LIG    1        6.958  -2.368  -1.367  0.00  0.00    -0.300 N 
ATOM     16  C   LIG    1        6.166  -1.157  -1.185  0.00  0.00    +0.130 C 
ATOM     17  C   LIG    1        4.884  -1.403  -1.996  0.00  0.00    +0.089 C 
ATOM     18  C   LIG    1        5.391  -2.309  -3.127  0.00  0.00    +0.042 C 
ATOM     19  C   LIG    1        6.446  -3.180  -2.457  0.00  0.00    +0.109 C 
ATOM     20  O   LIG    1        8.488  -1.829   0.244  0.00  0.00    -0.276 OA
ENDBRANCH  11  17
ENDBRANCH   5  11
ENDBRANCH   1   7
BRANCH   2  21
ATOM     21  C   LIG    1       -0.875   1.478  -0.373  0.00  0.00    +0.137 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -2.153   1.532   0.488  0.00  0.00    +0.145 C 
BRANCH  22  23
ATOM     23  O   LIG    1       -1.918   0.835   1.720  0.00  0.00    -0.389 OA
ATOM     24  H   LIG    1       -1.800  -0.107   1.507  0.00  0.00    +0.210 HD
ENDBRANCH  22  23
BRANCH  22  25
ATOM     25  C   LIG    1       -3.334   0.889  -0.286  0.00  0.00    +0.117 C 
BRANCH  25  26
ATOM     26  N   LIG    1       -4.694   1.013   0.262  0.00  0.00    -0.295 NA
ATOM     27  C   LIG    1       -5.204   2.393   0.205  0.00  0.00    +0.120 C 
ATOM     28  C   LIG    1       -6.608   2.533   0.758  0.00  0.00    -0.030 A 
ATOM     29  C   LIG    1       -7.130   1.577   1.647  0.00  0.00    -0.042 A 
ATOM     30  C   LIG    1       -8.418   1.744   2.172  0.00  0.00    +0.004 A 
ATOM     31  C   LIG    1       -9.176   2.864   1.835  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -8.656   3.822   0.967  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -6.330   0.341   1.978  0.00  0.00    +0.051 C 
ATOM     34  C   LIG    1       -7.377   3.660   0.434  0.00  0.00    +0.005 A 
ATOM     35  C   LIG    1       -4.842   0.486   1.624  0.00  0.00    +0.089 C 
ENDBRANCH  25  26
ENDBRANCH  22  25
ENDBRANCH  21  22
ENDBRANCH   2  21
TORSDOF 8