REMARK  Name = BDB051193
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.852  -1.388  -0.087  0.00  0.00    +0.137 A 
ATOM      2  C   LIG    1       -0.763  -2.730   0.328  0.00  0.00    +0.041 A 
ATOM      3  C   LIG    1        0.489  -3.108   0.812  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        0.683  -4.423   1.222  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1       -0.341  -5.372   1.177  0.00  0.00    +0.002 A 
ATOM      6  C   LIG    1       -1.595  -5.004   0.716  0.00  0.00    +0.001 A 
ATOM      7  N   LIG    1        1.517  -2.264   0.906  0.00  0.00    -0.214 NA
ATOM      8  C   LIG    1        1.341  -0.979   0.563  0.00  0.00    +0.224 A 
ATOM      9  C   LIG    1       -1.810  -3.693   0.295  0.00  0.00    +0.013 A 
ATOM     10  N   LIG    1        0.175  -0.527   0.072  0.00  0.00    -0.198 NA
ENDROOT
BRANCH   1  11
ATOM     11  N   LIG    1       -2.078  -0.907  -0.627  0.00  0.00    -0.284 N 
ATOM     12  H   LIG    1       -2.588  -1.634  -1.115  0.00  0.00    +0.155 HD
BRANCH  11  18
ATOM     13  C   LIG    1       -4.028   3.340  -2.353  0.00  0.00    +0.067 C 
ATOM     14  C   LIG    1       -3.173   2.287  -1.757  0.00  0.00    +0.062 A 
ATOM     15  N   LIG    1       -1.977   2.601  -1.247  0.00  0.00    -0.178 NA
ATOM     16  N   LIG    1       -1.495   1.420  -0.812  0.00  0.00    -0.264 N 
ATOM     17  H   LIG    1       -0.563   1.368  -0.413  0.00  0.00    +0.190 HD
ATOM     18  C   LIG    1       -2.350   0.368  -1.005  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1       -3.448   0.903  -1.636  0.00  0.00    +0.068 A 
ENDBRANCH  11  18
ENDBRANCH   1  11
BRANCH   8  20
ATOM     20  N   LIG    1        2.422  -0.082   0.711  0.00  0.00    -0.273 N 
ATOM     21  C   LIG    1        3.731  -0.727   0.723  0.00  0.00    +0.138 C 
BRANCH  20  22
ATOM     22  C   LIG    1        2.379   1.304   0.468  0.00  0.00    +0.036 A 
ATOM     23  C   LIG    1        3.285   1.949  -0.389  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1        3.211   3.327  -0.618  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        2.229   4.088   0.009  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        1.326   3.474   0.870  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        1.406   2.097   1.099  0.00  0.00    +0.023 A 
ENDBRANCH  20  22
ENDBRANCH   8  20
TORSDOF 4