REMARK  Name = BDB007711
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.238  -0.049   1.970  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1       -1.565  -0.391   1.828  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1       -1.874  -0.825   0.967  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        0.159   0.756   2.806  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   7
ATOM      5  C   LIG    1        2.849  -0.519  -0.178  0.00  0.00    +0.028 A 
ATOM      6  C   LIG    1        1.899   0.011   0.708  0.00  0.00    +0.036 A 
ATOM      7  C   LIG    1        0.711  -0.672   1.008  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1        0.456  -1.910   0.414  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1        1.369  -2.434  -0.498  0.00  0.00    +0.003 A 
ATOM     10  C   LIG    1        2.542  -1.734  -0.802  0.00  0.00    +0.023 A 
BRANCH   5  11
ATOM     11  N   LIG    1        3.971   0.254  -0.483  0.00  0.00    -0.341 N 
ATOM     12  H   LIG    1        4.194   0.901   0.272  0.00  0.00    +0.146 HD
BRANCH  11  17
ATOM     13  C   LIG    1        9.315   0.168  -0.899  0.00  0.00    +0.104 C 
ATOM     14  N   LIG    1        8.019   0.102  -0.230  0.00  0.00    -0.305 NA
ATOM     15  C   LIG    1        7.416  -1.227  -0.385  0.00  0.00    +0.086 C 
ATOM     16  C   LIG    1        5.921  -1.209  -0.085  0.00  0.00    +0.037 C 
ATOM     17  C   LIG    1        5.175  -0.326  -1.095  0.00  0.00    +0.073 C 
ATOM     18  C   LIG    1        6.063   0.812  -1.627  0.00  0.00    +0.037 C 
ATOM     19  C   LIG    1        7.135   1.209  -0.617  0.00  0.00    +0.086 C 
ENDBRANCH  11  17
ENDBRANCH   5  11
ENDBRANCH   1   7
BRANCH   2  20
ATOM     20  C   LIG    1       -2.596   0.260   2.612  0.00  0.00    +0.137 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -2.898   1.706   2.182  0.00  0.00    +0.145 C 
BRANCH  21  22
ATOM     22  O   LIG    1       -3.982   2.237   2.958  0.00  0.00    -0.389 OA
ATOM     23  H   LIG    1       -3.679   2.254   3.883  0.00  0.00    +0.210 HD
ENDBRANCH  21  22
BRANCH  21  24
ATOM     24  C   LIG    1       -3.205   1.860   0.670  0.00  0.00    +0.117 C 
BRANCH  24  25
ATOM     25  N   LIG    1       -4.125   0.862   0.076  0.00  0.00    -0.295 NA
ATOM     26  C   LIG    1       -5.491   1.006   0.629  0.00  0.00    +0.120 C 
ATOM     27  C   LIG    1       -6.531   0.165  -0.085  0.00  0.00    -0.030 A 
ATOM     28  C   LIG    1       -6.300  -0.333  -1.379  0.00  0.00    -0.042 A 
ATOM     29  C   LIG    1       -7.290  -1.087  -2.024  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -8.514  -1.324  -1.399  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -8.755  -0.815  -0.125  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -4.967  -0.105  -2.041  0.00  0.00    +0.051 C 
ATOM     33  C   LIG    1       -7.771  -0.072   0.528  0.00  0.00    +0.005 A 
ATOM     34  C   LIG    1       -4.176   1.034  -1.387  0.00  0.00    +0.089 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   2  20
TORSDOF 8