REMARK  Name = BDB019070
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.622  -0.301  -0.198  0.00  0.00    +0.027 A 
ATOM      2  C   LIG    1        0.895   0.899   0.022  0.00  0.00    +0.078 A 
ATOM      3  N   LIG    1       -0.476   0.830  -0.092  0.00  0.00    -0.271 N 
ATOM      4  C   LIG    1       -0.950   2.102   0.094  0.00  0.00    +0.206 A 
ATOM      5  N   LIG    1        0.013   2.951   0.383  0.00  0.00    -0.243 NA
ATOM      6  C   LIG    1       -1.160  -0.363  -0.383  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1       -0.485  -1.459  -0.609  0.00  0.00    -0.223 NA
ATOM      8  C   LIG    1        1.168   2.209   0.343  0.00  0.00    +0.139 A 
ATOM      9  C   LIG    1        0.893  -1.395  -0.514  0.00  0.00    +0.125 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        5.863  -0.673   0.004  0.00  0.00    +0.121 A 
ATOM     11  N   LIG    1        5.081  -1.408   0.826  0.00  0.00    -0.240 NA
ATOM     12  C   LIG    1        3.736  -1.264   0.739  0.00  0.00    +0.121 A 
ATOM     13  C   LIG    1        3.090  -0.417  -0.153  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        3.900   0.329  -1.003  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        5.288   0.196  -0.927  0.00  0.00    +0.044 A 
BRANCH  10  17
ATOM     16  C   LIG    1        7.942   0.452   0.371  0.00  0.00    +0.130 C 
ATOM     17  N   LIG    1        7.266  -0.808   0.060  0.00  0.00    -0.321 N 
ATOM     18  C   LIG    1        7.693  -1.933   0.892  0.00  0.00    +0.130 C 
ENDBRANCH  10  17
ENDBRANCH   1  13
BRANCH   6  19
ATOM     19  N   LIG    1       -2.536  -0.395  -0.455  0.00  0.00    -0.310 N 
ATOM     20  H   LIG    1       -2.785  -1.291  -0.877  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -3.312  -0.263   0.778  0.00  0.00    +0.143 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -4.773  -0.446   0.486  0.00  0.00    +0.012 A 
ATOM     23  C   LIG    1       -5.491   0.413  -0.343  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1       -5.037   1.581  -1.136  0.00  0.00    +0.080 C 
ATOM     25  C   LIG    1       -6.396   2.162  -1.526  0.00  0.00    +0.234 C 
ATOM     26  O   LIG    1       -7.395   1.120  -1.450  0.00  0.00    -0.491 OA
ATOM     27  C   LIG    1       -6.840   0.200  -0.599  0.00  0.00    +0.124 A 
ATOM     28  C   LIG    1       -7.538  -0.858  -0.052  0.00  0.00    +0.049 A 
ATOM     29  C   LIG    1       -6.845  -1.722   0.794  0.00  0.00    +0.042 A 
ATOM     30  C   LIG    1       -5.485  -1.511   1.056  0.00  0.00    +0.129 A 
ATOM     31  F   LIG    1       -4.854  -2.368   1.872  0.00  0.00    -0.205 F 
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   6  19
TORSDOF 5