REMARK  Name = BDB014411
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.799  -0.243  -1.135  0.00  0.00    +0.146 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1       -0.425   0.657  -0.082  0.00  0.00    -0.389 OA
ATOM      3  H   LIG    1        0.056   0.144   0.603  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1        0.093  -1.507  -1.123  0.00  0.00    +0.140 C 
BRANCH   4   6
ATOM      5  C   LIG    1        2.032  -0.908  -2.566  0.00  0.00    +0.132 C 
ATOM      6  N   LIG    1        1.529  -1.212  -1.235  0.00  0.00    -0.299 N 
ATOM      7  C   LIG    1        2.209  -0.864  -0.062  0.00  0.00    +0.253 C 
ATOM      8  O   LIG    1        1.626  -0.877   1.027  0.00  0.00    -0.272 OA
BRANCH   7   9
ATOM      9  C   LIG    1        3.684  -0.467  -0.198  0.00  0.00    +0.324 C 
BRANCH   9  10
ATOM     10  O   LIG    1        4.256  -0.184   1.072  0.00  0.00    -0.483 OA
BRANCH  10  11
ATOM     11  C   LIG    1        5.572   0.187   1.096  0.00  0.00    +0.121 A 
ATOM     12  C   LIG    1        6.414   0.310  -0.010  0.00  0.00    +0.045 A 
ATOM     13  C   LIG    1        7.746   0.700   0.162  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        8.242   0.967   1.437  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        7.406   0.845   2.544  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        6.076   0.456   2.372  0.00  0.00    +0.045 A 
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   7   9
ENDBRANCH   4   6
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  C   LIG    1       -2.287  -0.650  -0.982  0.00  0.00    +0.117 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -3.259   0.348  -1.482  0.00  0.00    -0.295 NA
ATOM     19  C   LIG    1       -4.642  -0.164  -1.399  0.00  0.00    +0.120 C 
ATOM     20  C   LIG    1       -5.257  -0.131  -0.016  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1       -4.770   0.745   0.971  0.00  0.00    -0.042 A 
ATOM     22  C   LIG    1       -5.378   0.780   2.233  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1       -6.479  -0.032   2.507  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.977  -0.885   1.525  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -3.555   1.599   0.697  0.00  0.00    +0.051 C 
ATOM     26  C   LIG    1       -6.372  -0.933   0.269  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -3.196   1.651  -0.795  0.00  0.00    +0.089 C 
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8