REMARK  Name = BDB064191
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.764   1.021   0.208  0.00  0.00    +0.136 A 
ATOM      2  C   LIG    1       -0.362   0.906   0.250  0.00  0.00    +0.041 A 
ATOM      3  C   LIG    1        0.154  -0.328  -0.145  0.00  0.00    +0.078 A 
ATOM      4  C   LIG    1        1.536  -0.509  -0.141  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        2.457   0.480   0.252  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        1.914   1.703   0.652  0.00  0.00    +0.024 A 
ATOM      7  N   LIG    1       -0.623  -1.346  -0.531  0.00  0.00    -0.227 NA
ATOM      8  C   LIG    1       -1.958  -1.164  -0.501  0.00  0.00    +0.164 A 
ATOM      9  C   LIG    1        0.533   1.920   0.659  0.00  0.00    +0.015 A 
ATOM     10  N   LIG    1       -2.544  -0.006  -0.165  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   5  11
ATOM     11  N   LIG    1        3.823   0.251   0.237  0.00  0.00    -0.327 N 
ATOM     12  C   LIG    1        4.801   1.350   0.297  0.00  0.00    +0.120 C 
ATOM     13  C   LIG    1        6.158   0.898  -0.291  0.00  0.00    +0.103 C 
ATOM     14  N   LIG    1        6.779  -0.237   0.425  0.00  0.00    -0.302 NA
ATOM     15  C   LIG    1        7.682  -0.969  -0.459  0.00  0.00    +0.105 C 
ATOM     16  C   LIG    1        5.757  -1.121   1.022  0.00  0.00    +0.103 C 
ATOM     17  C   LIG    1        4.372  -1.115   0.332  0.00  0.00    +0.120 C 
ENDBRANCH   5  11
BRANCH   8  18
ATOM     18  C   LIG    1       -2.840  -2.283  -0.922  0.00  0.00    +0.040 A 
ATOM     19  C   LIG    1       -2.377  -3.602  -1.167  0.00  0.00    +0.035 A 
ATOM     20  C   LIG    1       -3.288  -4.609  -1.536  0.00  0.00    +0.023 A 
ATOM     21  C   LIG    1       -4.638  -4.327  -1.736  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -5.105  -3.037  -1.534  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1       -4.220  -2.036  -1.126  0.00  0.00    +0.013 A 
BRANCH  19  24
ATOM     24  N   LIG    1       -1.061  -4.013  -0.854  0.00  0.00    -0.357 N 
ATOM     25  H   LIG    1       -0.429  -3.208  -0.809  0.00  0.00    +0.142 HD
ATOM     26  H   LIG    1       -0.712  -4.754  -1.450  0.00  0.00    +0.142 HD
ENDBRANCH  19  24
ENDBRANCH   8  18
BRANCH   1  27
ATOM     27  N   LIG    1       -2.364   2.264   0.542  0.00  0.00    -0.282 N 
ATOM     28  H   LIG    1       -1.916   3.003   0.018  0.00  0.00    +0.155 HD
BRANCH  27  34
ATOM     29  C   LIG    1       -6.677   4.520   1.428  0.00  0.00    +0.065 C 
ATOM     30  C   LIG    1       -5.534   3.591   1.308  0.00  0.00    +0.035 A 
ATOM     31  N   LIG    1       -5.577   2.309   1.778  0.00  0.00    -0.280 N 
ATOM     32  H   LIG    1       -6.343   1.835   2.245  0.00  0.00    +0.189 HD
ATOM     33  N   LIG    1       -4.441   1.629   1.589  0.00  0.00    -0.158 NA
ATOM     34  C   LIG    1       -3.638   2.477   0.944  0.00  0.00    +0.146 A 
ATOM     35  C   LIG    1       -4.276   3.731   0.764  0.00  0.00    +0.068 A 
ENDBRANCH  27  34
ENDBRANCH   1  27
TORSDOF 5