REMARK  Name = BDB001411
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.609  -1.031   0.424  0.00  0.00    +0.058 C 
ATOM      2  N   LIG    1       -2.246   0.070   0.133  0.00  0.00    -0.251 NA
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -2.261  -2.331   0.046  0.00  0.00    -0.003 A 
ATOM      4  C   LIG    1       -3.653  -2.359  -0.129  0.00  0.00    +0.010 A 
ATOM      5  C   LIG    1       -4.303  -3.547  -0.471  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -3.567  -4.716  -0.648  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -2.183  -4.696  -0.489  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -1.530  -3.509  -0.145  0.00  0.00    +0.010 A 
ENDBRANCH   1   3
BRANCH   2   9
ATOM      9  C   LIG    1       -1.709   1.324   0.441  0.00  0.00    +0.064 A 
ATOM     10  C   LIG    1       -1.004   2.037  -0.531  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1       -0.470   3.293  -0.239  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -0.655   3.852   1.024  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -1.384   3.159   1.991  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -1.917   1.903   1.695  0.00  0.00    +0.028 A 
ENDBRANCH   2   9
BRANCH   1  15
ATOM     15  C   LIG    1       -0.275  -1.079   1.153  0.00  0.00    +0.152 C 
BRANCH  15  17
ATOM     16  O   LIG    1        1.227  -1.717  -0.586  0.00  0.00    -0.275 OA
ATOM     17  C   LIG    1        0.922  -0.871   0.250  0.00  0.00    +0.223 C 
ATOM     18  N   LIG    1        1.592   0.313   0.500  0.00  0.00    -0.285 N 
ATOM     19  H   LIG    1        1.149   0.960   1.143  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1        2.757   0.795  -0.132  0.00  0.00    +0.033 A 
ATOM     21  C   LIG    1        3.488   0.077  -1.079  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1        4.635   0.632  -1.657  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1        5.061   1.907  -1.292  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.341   2.630  -0.345  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        3.195   2.076   0.232  0.00  0.00    +0.023 A 
ENDBRANCH  18  20
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 5