REMARK  Name = BDB027640
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.553  -1.048   0.013  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        1.912  -2.359   0.372  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        3.277  -2.646   0.332  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        3.639  -3.940   0.675  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.794  -4.937   1.049  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.488  -4.622   1.095  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        4.203  -1.741  -0.013  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        3.769  -0.508  -0.315  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        1.003  -3.369   0.772  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        2.478  -0.136  -0.315  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.778   0.504  -0.678  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        4.420   1.830  -0.966  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        5.404   2.747  -1.303  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        6.715   2.446  -1.376  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        7.056   1.172  -1.098  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        6.144   0.188  -0.751  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        0.193  -0.704  -0.000  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1       -0.271  -1.364  -0.618  0.00  0.00    +0.148 HD
BRANCH  17  20
ATOM     19  C   LIG    1        0.291   1.629   0.847  0.00  0.00    +0.032 C 
ATOM     20  C   LIG    1       -0.332   0.673  -0.198  0.00  0.00    +0.033 C 
ATOM     21  C   LIG    1        0.029   1.171  -1.615  0.00  0.00    +0.032 C 
BRANCH  20  22
ATOM     22  C   LIG    1       -1.935   0.591  -0.005  0.00  0.00    -0.008 C 
ATOM     23  C   LIG    1       -2.614   2.000  -0.028  0.00  0.00    +0.012 C 
ATOM     24  C   LIG    1       -4.140   1.904   0.162  0.00  0.00    -0.010 C 
ATOM     25  C   LIG    1       -4.744   1.057  -0.965  0.00  0.00    +0.007 C 
ATOM     26  C   LIG    1       -4.140  -0.353  -0.934  0.00  0.00    -0.010 C 
ATOM     27  C   LIG    1       -4.436  -1.010   0.421  0.00  0.00    +0.007 C 
ATOM     28  C   LIG    1       -3.835  -0.165   1.552  0.00  0.00    -0.010 C 
ATOM     29  C   LIG    1       -4.442   1.244   1.514  0.00  0.00    +0.007 C 
ATOM     30  C   LIG    1       -2.617  -0.255  -1.132  0.00  0.00    +0.012 C 
ATOM     31  C   LIG    1       -2.310  -0.069   1.363  0.00  0.00    +0.012 C 
ENDBRANCH  20  22
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 4