REMARK  Name = BDB048447
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.059  -0.841   0.101  0.00  0.00    -0.028 A 
ATOM      2  C   LIG    1        0.539  -1.049   1.352  0.00  0.00    +0.006 A 
ATOM      3  C   LIG    1        1.884  -0.732   1.565  0.00  0.00    +0.009 A 
ATOM      4  C   LIG    1        2.672  -0.212   0.529  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        2.077  -0.015  -0.724  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        0.732  -0.331  -0.939  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        4.088   0.122   0.748  0.00  0.00    -0.001 A 
ATOM      8  C   LIG    1        5.086  -0.862   0.909  0.00  0.00    +0.059 A 
ATOM      9  C   LIG    1        6.423  -0.484   1.115  0.00  0.00    +0.019 A 
ATOM     10  C   LIG    1        6.780   0.863   1.160  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        5.804   1.842   0.999  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.473   1.475   0.794  0.00  0.00    +0.010 A 
BRANCH   8  13
ATOM     13  C   LIG    1        4.776  -2.264   0.859  0.00  0.00    +0.100 C 
ATOM     14  N   LIG    1        4.550  -3.402   0.832  0.00  0.00    -0.191 NA
ENDBRANCH   8  13
ENDBRANCH   4   7
BRANCH   1  15
ATOM     15  C   LIG    1       -1.504  -1.226  -0.112  0.00  0.00    +0.158 C 
BRANCH  15  17
ATOM     16  C   LIG    1       -2.806   0.946  -0.231  0.00  0.00    +0.111 A 
ATOM     17  N   LIG    1       -2.277  -0.198  -0.796  0.00  0.00    -0.323 N 
ATOM     18  C   LIG    1       -2.663  -0.237  -2.120  0.00  0.00    +0.069 A 
ATOM     19  C   LIG    1       -3.409   0.924  -2.292  0.00  0.00    +0.089 A 
ATOM     20  C   LIG    1       -3.961   1.213  -3.548  0.00  0.00    +0.030 A 
ATOM     21  C   LIG    1       -3.746   0.319  -4.603  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -2.994  -0.841  -4.410  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -2.435  -1.146  -3.163  0.00  0.00    +0.028 A 
ATOM     24  N   LIG    1       -3.486   1.637  -1.125  0.00  0.00    -0.232 NA
BRANCH  16  25
ATOM     25  C   LIG    1       -2.637   1.351   1.198  0.00  0.00    +0.074 C 
BRANCH  25  27
ATOM     26  C   LIG    1       -3.617   1.242   3.516  0.00  0.00    +0.004 C 
ATOM     27  C   LIG    1       -3.785   0.829   2.063  0.00  0.00    +0.004 C 
ENDBRANCH  25  27
ENDBRANCH  16  25
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 6