REMARK  Name = BDB032196
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.762  -0.697   0.614  0.00  0.00    +0.138 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1       -2.289   0.545   0.876  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1       -1.824   0.100  -0.309  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1       -0.527  -0.282  -0.347  0.00  0.00    +0.119 A 
ATOM      5  C   LIG    1        0.331  -0.256   0.749  0.00  0.00    -0.012 A 
ATOM      6  C   LIG    1       -0.186   0.217   1.957  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -1.517   0.621   2.023  0.00  0.00    +0.067 A 
BRANCH   2   8
ATOM      8  O   LIG    1       -3.603   0.950   1.001  0.00  0.00    -0.473 OA
BRANCH   8  13
ATOM      9  C   LIG    1       -8.240  -0.667   0.146  0.00  0.00    +0.104 C 
ATOM     10  N   LIG    1       -7.288   0.235  -0.497  0.00  0.00    -0.305 NA
ATOM     11  C   LIG    1       -6.788   1.230   0.463  0.00  0.00    +0.087 C 
ATOM     12  C   LIG    1       -5.526   1.919  -0.046  0.00  0.00    +0.060 C 
ATOM     13  C   LIG    1       -4.376   0.912  -0.210  0.00  0.00    +0.178 C 
ATOM     14  C   LIG    1       -4.900  -0.512  -0.444  0.00  0.00    +0.060 C 
ATOM     15  C   LIG    1       -6.224  -0.496  -1.199  0.00  0.00    +0.087 C 
ENDBRANCH   8  13
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  16
ATOM     16  N   LIG    1        2.517   0.322  -0.099  0.00  0.00    -0.340 N 
ATOM     17  H   LIG    1        2.249   1.267   0.169  0.00  0.00    +0.146 HD
BRANCH  16  18
ATOM     18  C   LIG    1        3.901   0.194  -0.241  0.00  0.00    +0.028 A 
ATOM     19  C   LIG    1        4.583  -1.027  -0.167  0.00  0.00    +0.031 A 
ATOM     20  C   LIG    1        5.974  -1.120  -0.385  0.00  0.00    -0.011 A 
ATOM     21  C   LIG    1        6.711   0.034  -0.712  0.00  0.00    +0.022 A 
ATOM     22  C   LIG    1        8.102  -0.114  -0.909  0.00  0.00    +0.124 A 
ATOM     23  N   LIG    1        8.746  -1.293  -0.823  0.00  0.00    -0.240 NA
ATOM     24  C   LIG    1        8.006  -2.378  -0.523  0.00  0.00    +0.113 A 
ATOM     25  C   LIG    1        6.016   1.254  -0.838  0.00  0.00    +0.014 A 
ATOM     26  C   LIG    1        6.642  -2.345  -0.294  0.00  0.00    +0.028 A 
ATOM     27  C   LIG    1        4.637   1.323  -0.619  0.00  0.00    +0.023 A 
BRANCH  22  28
ATOM     28  N   LIG    1        8.923   0.975  -1.221  0.00  0.00    -0.343 N 
ATOM     29  H   LIG    1        9.870   0.606  -1.273  0.00  0.00    +0.144 HD
ATOM     30  H   LIG    1        8.844   1.695  -0.513  0.00  0.00    +0.144 HD
ENDBRANCH  22  28
ENDBRANCH  16  18
ENDBRANCH   1  16
TORSDOF 6