REMARK  Name = BDB034272
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.832   0.932  -1.049  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1       -1.897  -0.428  -1.359  0.00  0.00    +0.074 A 
ATOM      3  C   LIG    1       -0.793  -1.257  -1.222  0.00  0.00    +0.076 A 
ATOM      4  C   LIG    1        0.431  -0.715  -0.759  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        1.540  -1.600  -0.606  0.00  0.00    +0.038 A 
ATOM      6  C   LIG    1        1.375  -2.927  -1.005  0.00  0.00    +0.043 A 
ATOM      7  C   LIG    1        0.136  -3.348  -1.452  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1        0.489   0.675  -0.488  0.00  0.00    +0.015 A 
ATOM      9  N   LIG    1       -0.940  -2.547  -1.550  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1       -0.632   1.491  -0.636  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   5  11
ATOM     11  N   LIG    1        2.783  -1.100  -0.167  0.00  0.00    -0.343 N 
ATOM     12  H   LIG    1        2.646  -0.410   0.570  0.00  0.00    +0.146 HD
BRANCH  11  13
ATOM     13  C   LIG    1        3.886  -2.007   0.135  0.00  0.00    +0.103 C 
BRANCH  13  14
ATOM     14  C   LIG    1        5.108  -1.221   0.618  0.00  0.00    +0.034 C 
BRANCH  14  15
ATOM     15  C   LIG    1        5.696  -0.334  -0.484  0.00  0.00    +0.083 C 
BRANCH  15  16
ATOM     16  N   LIG    1        6.847   0.446  -0.018  0.00  0.00    -0.309 NA
ATOM     17  H   LIG    1        7.020   1.202  -0.680  0.00  0.00    +0.122 HD
BRANCH  16  18
ATOM     18  C   LIG    1        8.069  -0.359   0.083  0.00  0.00    +0.155 C 
BRANCH  18  19
ATOM     19  C   LIG    1        9.229   0.491   0.471  0.00  0.00    +0.119 A 
ATOM     20  O   LIG    1        9.767   0.269   1.706  0.00  0.00    -0.467 OA
ATOM     21  C   LIG    1       10.800   1.137   1.852  0.00  0.00    +0.195 A 
ATOM     22  C   LIG    1       10.944   1.910   0.725  0.00  0.00    +0.041 A 
ATOM     23  C   LIG    1        9.930   1.492  -0.171  0.00  0.00    +0.046 A 
ENDBRANCH  18  19
ENDBRANCH  16  18
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   5  11
BRANCH   1  24
ATOM     24  O   LIG    1       -2.897   1.788  -1.210  0.00  0.00    -0.456 OA
BRANCH  24  28
ATOM     25  C   LIG    1       -6.700   0.658   0.176  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1       -5.564   0.501   0.997  0.00  0.00    +0.008 A 
ATOM     27  C   LIG    1       -4.287   0.864   0.557  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1       -4.117   1.379  -0.725  0.00  0.00    +0.128 A 
ATOM     29  C   LIG    1       -5.224   1.568  -1.546  0.00  0.00    +0.046 A 
ATOM     30  C   LIG    1       -6.500   1.205  -1.103  0.00  0.00    +0.008 A 
BRANCH  25  32
ATOM     31  C   LIG    1       -8.085  -1.259   1.048  0.00  0.00    +0.015 C 
ATOM     32  C   LIG    1       -8.089   0.244   0.695  0.00  0.00    -0.013 C 
ATOM     33  C   LIG    1       -9.229   0.470  -0.323  0.00  0.00    +0.015 C 
ATOM     34  C   LIG    1       -8.436   1.062   1.958  0.00  0.00    +0.015 C 
ENDBRANCH  25  32
ENDBRANCH  24  28
ENDBRANCH   1  24
TORSDOF 10