REMARK  Name = BDB019005
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.570  -1.103  -0.347  0.00  0.00    -0.298 N 
ATOM      2  C   LIG    1       -0.743  -0.592  -0.164  0.00  0.00    +0.038 A 
ATOM      3  C   LIG    1       -1.754  -0.788  -1.122  0.00  0.00    -0.025 A 
ATOM      4  C   LIG    1       -3.042  -0.267  -0.908  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -3.343   0.490   0.233  0.00  0.00    -0.006 A 
ATOM      6  C   LIG    1       -2.339   0.729   1.183  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1       -1.496  -1.577  -2.379  0.00  0.00    +0.038 C 
ATOM      8  C   LIG    1       -0.009  -1.673  -2.673  0.00  0.00    +0.024 C 
ATOM      9  C   LIG    1       -1.053   0.196   0.960  0.00  0.00    +0.033 A 
ATOM     10  C   LIG    1        0.719  -2.113  -1.413  0.00  0.00    +0.111 C 
ENDROOT
BRANCH   1  19
ATOM     11  C   LIG    1        4.601   0.502  -0.304  0.00  0.00    +0.037 A 
ATOM     12  C   LIG    1        3.289   0.009  -0.322  0.00  0.00    +0.023 A 
ATOM     13  C   LIG    1        2.802  -0.840   0.699  0.00  0.00    +0.007 A 
ATOM     14  C   LIG    1        3.674  -1.162   1.763  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        3.188  -1.990   2.778  0.00  0.00    +0.119 A 
ATOM     16  N   LIG    1        1.944  -2.513   2.818  0.00  0.00    -0.261 NA
ATOM     17  C   LIG    1        1.128  -2.185   1.792  0.00  0.00    +0.134 A 
ATOM     18  C   LIG    1        4.982  -0.647   1.788  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1        1.487  -1.369   0.712  0.00  0.00    +0.060 A 
ATOM     20  C   LIG    1        5.443   0.181   0.763  0.00  0.00    +0.014 A 
BRANCH  11  24
ATOM     21  C   LIG    1        6.908   2.127  -2.826  0.00  0.00    +0.128 C 
ATOM     22  N   LIG    1        6.400   1.400  -1.690  0.00  0.00    -0.314 N 
ATOM     23  H   LIG    1        6.982   0.672  -1.302  0.00  0.00    +0.149 HD
ATOM     24  C   LIG    1        5.044   1.379  -1.426  0.00  0.00    +0.244 C 
ATOM     25  O   LIG    1        4.221   2.005  -2.084  0.00  0.00    -0.270 OA
ENDBRANCH  11  24
ENDBRANCH   1  19
BRANCH   5  26
ATOM     26  C   LIG    1       -4.687   1.008   0.384  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1       -5.815   0.221   0.477  0.00  0.00    +0.116 A 
ATOM     28  N   LIG    1       -6.865   1.082   0.611  0.00  0.00    -0.274 N 
ATOM     29  C   LIG    1       -8.260   0.739   0.745  0.00  0.00    +0.172 C 
ATOM     30  N   LIG    1       -6.500   2.377   0.617  0.00  0.00    -0.179 NA
ATOM     31  C   LIG    1       -5.173   2.331   0.467  0.00  0.00    +0.142 A 
ENDBRANCH   5  26
BRANCH   6  32
ATOM     32  C   LIG    1       -2.588   1.550   2.423  0.00  0.00    +0.372 C 
ATOM     33  F   LIG    1       -2.660   2.884   2.157  0.00  0.00    -0.204 F 
ATOM     34  F   LIG    1       -1.605   1.421   3.362  0.00  0.00    -0.204 F 
ENDBRANCH   6  32
TORSDOF 4