REMARK  Name = BDB027754
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.149   0.861  -0.572  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -1.077   1.953  -1.454  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        0.186   2.199  -1.990  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        0.277   3.265  -2.872  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1       -0.742   4.083  -3.248  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -1.941   3.830  -2.700  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        1.264   1.463  -1.687  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.108   0.461  -0.803  0.00  0.00    +0.163 A 
ATOM      9  C   LIG    1       -2.159   2.794  -1.812  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -0.063   0.142  -0.233  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.302  -0.342  -0.504  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1        2.373  -1.227   0.601  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1        3.557  -1.941   0.783  0.00  0.00    +0.139 A 
ATOM     14  N   LIG    1        3.425  -2.729   1.893  0.00  0.00    -0.346 N 
ATOM     15  H   LIG    1        4.153  -3.341   2.229  0.00  0.00    +0.167 HD
ATOM     16  C   LIG    1        2.189  -2.545   2.450  0.00  0.00    +0.085 A 
ATOM     17  N   LIG    1        4.671  -1.902   0.033  0.00  0.00    -0.237 NA
ATOM     18  C   LIG    1        4.574  -1.047  -1.003  0.00  0.00    +0.114 A 
ATOM     19  C   LIG    1        1.520  -1.622   1.676  0.00  0.00    +0.030 A 
ATOM     20  C   LIG    1        3.463  -0.275  -1.305  0.00  0.00    +0.032 A 
ENDBRANCH   8  11
BRANCH   1  21
ATOM     21  N   LIG    1       -2.414   0.528  -0.006  0.00  0.00    -0.323 N 
ATOM     22  H   LIG    1       -3.089   0.428  -0.760  0.00  0.00    +0.148 HD
BRANCH  21  24
ATOM     23  C   LIG    1       -2.393  -1.950   0.527  0.00  0.00    +0.031 C 
ATOM     24  C   LIG    1       -2.520  -0.530   1.027  0.00  0.00    +0.031 C 
ATOM     25  C   LIG    1       -3.545  -0.293   2.120  0.00  0.00    +0.027 C 
ATOM     26  C   LIG    1       -2.084  -0.228   2.443  0.00  0.00    +0.027 C 
ENDBRANCH  21  24
ENDBRANCH   1  21
TORSDOF 3