REMARK  Name = BDB027779
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.397  -0.899  -0.127  0.00  0.00    +0.132 A 
ATOM      2  C   LIG    1       -0.938  -2.225  -0.180  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        0.442  -2.381  -0.052  0.00  0.00    +0.096 A 
ATOM      4  C   LIG    1        0.913  -3.685  -0.088  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        0.159  -4.805  -0.243  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1       -1.164  -4.618  -0.384  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        1.288  -1.349   0.094  0.00  0.00    -0.210 NA
ATOM      8  C   LIG    1        0.762  -0.114   0.098  0.00  0.00    +0.237 A 
ATOM      9  C   LIG    1       -1.754  -3.368  -0.360  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1       -0.553   0.140  -0.009  0.00  0.00    -0.196 NA
ENDROOT
BRANCH   8  11
ATOM     11  N   LIG    1        1.636   1.014   0.230  0.00  0.00    -0.284 N 
ATOM     12  C   LIG    1        3.024   1.008   0.363  0.00  0.00    +0.075 A 
ATOM     13  C   LIG    1        3.430   2.342   0.463  0.00  0.00    +0.089 A 
ATOM     14  N   LIG    1        4.721   2.727   0.606  0.00  0.00    -0.253 NA
ATOM     15  C   LIG    1        5.616   1.721   0.645  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        5.312   0.373   0.554  0.00  0.00    +0.022 A 
ATOM     17  C   LIG    1        2.288   3.163   0.389  0.00  0.00    +0.048 A 
ATOM     18  C   LIG    1        3.983  -0.015   0.408  0.00  0.00    +0.030 A 
ATOM     19  C   LIG    1        1.202   2.333   0.246  0.00  0.00    +0.097 A 
ENDBRANCH   8  11
BRANCH   1  20
ATOM     20  N   LIG    1       -2.791  -0.639  -0.245  0.00  0.00    -0.323 N 
ATOM     21  H   LIG    1       -3.294  -1.230   0.412  0.00  0.00    +0.148 HD
BRANCH  20  23
ATOM     22  C   LIG    1       -3.315   1.458   1.077  0.00  0.00    +0.031 C 
ATOM     23  C   LIG    1       -3.271   0.767  -0.266  0.00  0.00    +0.031 C 
ATOM     24  C   LIG    1       -3.015   1.616  -1.491  0.00  0.00    +0.027 C 
ATOM     25  C   LIG    1       -4.393   1.087  -1.231  0.00  0.00    +0.027 C 
ENDBRANCH  20  23
ENDBRANCH   1  20
TORSDOF 3