REMARK  Name = BDB023064
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.347  -0.532  -1.317  0.00  0.00    +0.253 C 
ATOM      2  C   LIG    1        0.040  -1.988  -0.961  0.00  0.00    +0.195 C 
ATOM      3  C   LIG    1       -1.372  -2.137  -1.495  0.00  0.00    +0.179 C 
ATOM      4  C   LIG    1       -1.996  -0.749  -1.298  0.00  0.00    +0.188 C 
ATOM      5  O   LIG    1       -0.896   0.186  -1.174  0.00  0.00    -0.345 OA
ENDROOT
BRANCH   1  11
ATOM      6  N   LIG    1        5.172   1.131   1.838  0.00  0.00    -0.065 NA
ATOM      7  C   LIG    1        4.582   0.307   1.036  0.00  0.00    +0.200 A 
ATOM      8  C   LIG    1        3.207   0.517   0.610  0.00  0.00    +0.153 A 
ATOM      9  N   LIG    1        2.335   1.527   0.924  0.00  0.00    -0.230 NA
ATOM     10  C   LIG    1        1.238   1.239   0.254  0.00  0.00    +0.203 A 
ATOM     11  N   LIG    1        1.353   0.073  -0.460  0.00  0.00    -0.286 N 
ATOM     12  C   LIG    1        2.621  -0.402  -0.249  0.00  0.00    +0.168 A 
ATOM     13  N   LIG    1        3.156  -1.539  -0.784  0.00  0.00    -0.218 NA
ATOM     14  C   LIG    1        4.391  -1.688  -0.385  0.00  0.00    +0.200 A 
ATOM     15  N   LIG    1        5.075  -0.845   0.460  0.00  0.00    -0.327 N 
ATOM     16  H   LIG    1        6.032  -1.049   0.711  0.00  0.00    +0.168 HD
BRANCH   6  18
ATOM     17  C   LIG    1        7.100   1.636   2.966  0.00  0.00    +0.313 C 
ATOM     18  O   LIG    1        6.488   0.697   2.088  0.00  0.00    -0.395 OA
ENDBRANCH   6  18
ENDBRANCH   1  11
BRANCH   2  19
ATOM     19  O   LIG    1        0.895  -2.950  -1.585  0.00  0.00    -0.385 OA
ATOM     20  H   LIG    1        1.815  -2.687  -1.354  0.00  0.00    +0.210 HD
ENDBRANCH   2  19
BRANCH   3  21
ATOM     21  O   LIG    1       -1.290  -2.422  -2.905  0.00  0.00    -0.386 OA
ATOM     22  H   LIG    1       -0.569  -3.083  -2.985  0.00  0.00    +0.210 HD
ENDBRANCH   3  21
BRANCH   4  23
ATOM     23  C   LIG    1       -2.986  -0.629  -0.090  0.00  0.00    +0.117 C 
ATOM     24  C   LIG    1       -2.263  -0.732   1.261  0.00  0.00    +0.049 C 
BRANCH  23  25
ATOM     25  C   LIG    1       -3.857   0.640  -0.089  0.00  0.00    -0.012 A 
ATOM     26  C   LIG    1       -3.530   1.799  -0.814  0.00  0.00    +0.028 A 
ATOM     27  C   LIG    1       -4.348   2.939  -0.775  0.00  0.00    +0.060 A 
ATOM     28 CL   LIG    1       -3.858   4.308  -1.711  0.00  0.00    -0.082 Cl
ATOM     29  C   LIG    1       -5.510   2.942  -0.002  0.00  0.00    +0.059 A 
ATOM     30 CL   LIG    1       -6.564   4.307   0.092  0.00  0.00    -0.082 Cl
ATOM     31  C   LIG    1       -5.848   1.807   0.733  0.00  0.00    +0.022 A 
ATOM     32  C   LIG    1       -5.031   0.674   0.691  0.00  0.00    +0.008 A 
ENDBRANCH  23  25
BRANCH  23  33
ATOM     33  O   LIG    1       -3.885  -1.751  -0.165  0.00  0.00    -0.382 OA
ATOM     34  H   LIG    1       -4.532  -1.560  -0.869  0.00  0.00    +0.211 HD
ENDBRANCH  23  33
ENDBRANCH   4  23
TORSDOF 7