REMARK  Name = BDB062337
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.574  -0.526  -1.520  0.00  0.00    -0.332 N 
ATOM      2  C   LIG    1        0.904  -1.719  -1.536  0.00  0.00    +0.141 A 
ATOM      3  C   LIG    1       -0.442  -1.458  -1.798  0.00  0.00    +0.026 A 
ATOM      4  C   LIG    1       -1.313  -2.574  -1.889  0.00  0.00    -0.038 A 
ATOM      5  C   LIG    1       -0.741  -3.837  -1.663  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1        0.615  -3.946  -1.393  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1       -2.783  -2.485  -2.186  0.00  0.00    +0.044 C 
ATOM      8  C   LIG    1       -0.577  -0.026  -1.898  0.00  0.00    -0.003 A 
ATOM      9  N   LIG    1        1.479  -2.918  -1.320  0.00  0.00    -0.237 NA
ATOM     10  C   LIG    1        0.699   0.501  -1.749  0.00  0.00    +0.093 A 
ENDROOT
BRANCH   1  11
ATOM     11  C   LIG    1        3.002  -0.369  -1.311  0.00  0.00    +0.125 C 
BRANCH  11  12
ATOM     12  C   LIG    1        3.368  -0.006   0.126  0.00  0.00    +0.040 C 
BRANCH  12  13
ATOM     13  C   LIG    1        3.111  -1.148   1.108  0.00  0.00    +0.109 C 
BRANCH  13  15
ATOM     14  C   LIG    1        4.850  -0.902   2.841  0.00  0.00    +0.400 C 
ATOM     15  N   LIG    1        3.552  -0.805   2.442  0.00  0.00    -0.281 N 
ATOM     16  H   LIG    1        2.913  -0.396   3.109  0.00  0.00    +0.152 HD
ATOM     17  O   LIG    1        5.775  -1.306   2.153  0.00  0.00    -0.226 OA
BRANCH  14  19
ATOM     18  C   LIG    1        6.278  -0.522   4.645  0.00  0.00    +0.282 C 
ATOM     19  O   LIG    1        4.951  -0.467   4.120  0.00  0.00    -0.454 OA
ENDBRANCH  14  19
ENDBRANCH  13  15
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   1  11
BRANCH   8  20
ATOM     20  C   LIG    1       -1.849   0.740  -2.120  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -1.792   2.077  -1.521  0.00  0.00    -0.292 N 
ATOM     22  C   LIG    1       -1.799   2.316  -0.142  0.00  0.00    +0.246 C 
ATOM     23  O   LIG    1       -1.560   3.440   0.316  0.00  0.00    -0.273 OA
BRANCH  22  24
ATOM     24  C   LIG    1       -2.074   1.122   0.804  0.00  0.00    +0.217 C 
ATOM     25  O   LIG    1       -3.353   0.525   0.540  0.00  0.00    -0.365 OA
ATOM     26  C   LIG    1       -3.596  -0.577   1.423  0.00  0.00    +0.176 C 
ATOM     27  C   LIG    1       -3.541  -0.141   2.894  0.00  0.00    +0.109 C 
ATOM     28  N   LIG    1       -2.251   0.482   3.237  0.00  0.00    -0.311 NA
ATOM     29  H   LIG    1       -1.512  -0.213   3.129  0.00  0.00    +0.122 HD
ATOM     30  C   LIG    1       -2.001   1.586   2.279  0.00  0.00    +0.122 C 
ENDBRANCH  22  24
BRANCH  21  31
ATOM     31  C   LIG    1       -1.546   3.185  -2.422  0.00  0.00    +0.077 C 
ATOM     32  C   LIG    1       -2.421   3.450  -3.623  0.00  0.00    +0.024 C 
ATOM     33  C   LIG    1       -2.464   4.382  -2.454  0.00  0.00    +0.024 C 
ENDBRANCH  21  31
ENDBRANCH  20  21
ENDBRANCH   8  20
TORSDOF 9