REMARK  Name = BDB018735
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -7.110   2.033   0.782  0.00  0.00    -0.268 N 
ATOM      2  C   LIG    1       -6.353   1.636  -0.446  0.00  0.00    +0.132 C 
ATOM      3  C   LIG    1       -5.334   0.573  -0.007  0.00  0.00    +0.069 C 
ATOM      4  C   LIG    1       -5.827  -0.840  -0.329  0.00  0.00    +0.225 C 
ATOM      5  O   LIG    1       -7.009  -1.122  -0.512  0.00  0.00    -0.275 OA
ATOM      6  N   LIG    1       -4.887  -1.838  -0.287  0.00  0.00    -0.285 N 
ATOM      7  H   LIG    1       -5.244  -2.783  -0.358  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1       -3.509  -1.617  -0.241  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -3.014  -0.321  -0.395  0.00  0.00    -0.025 A 
ATOM     10  C   LIG    1       -1.630  -0.106  -0.373  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1       -0.732  -1.171  -0.184  0.00  0.00    -0.018 A 
ATOM     12  C   LIG    1       -1.261  -2.465  -0.035  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1       -2.640  -2.691  -0.072  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -3.975   0.802  -0.681  0.00  0.00    +0.054 C 
ATOM     15  C   LIG    1       -5.264   0.755   1.517  0.00  0.00    +0.037 C 
ATOM     16  C   LIG    1       -6.682   1.154   1.894  0.00  0.00    +0.117 C 
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1        0.721  -0.941  -0.152  0.00  0.00    -0.018 A 
ATOM     18  C   LIG    1        1.374  -0.279  -1.204  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1        2.758  -0.059  -1.178  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1        3.517  -0.497  -0.095  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1        2.879  -1.156   0.957  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1        1.499  -1.377   0.930  0.00  0.00    +0.012 A 
BRANCH  20  23
ATOM     23  O   LIG    1        4.866  -0.350   0.059  0.00  0.00    -0.487 OA
BRANCH  23  24
ATOM     24  C   LIG    1        5.572   0.315  -0.985  0.00  0.00    +0.264 C 
BRANCH  24  25
ATOM     25  C   LIG    1        7.032   0.368  -0.606  0.00  0.00    -0.010 A 
ATOM     26  C   LIG    1        7.523   1.417   0.184  0.00  0.00    +0.007 A 
ATOM     27  C   LIG    1        8.870   1.459   0.546  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        9.737   0.451   0.130  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        9.257  -0.605  -0.643  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.909  -0.650  -1.006  0.00  0.00    +0.007 A 
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  11  17
BRANCH   1  32
ATOM     31  N   LIG    1       -9.311   3.211   0.719  0.00  0.00    -0.174 NA
ATOM     32  C   LIG    1       -8.293   2.661   0.748  0.00  0.00    +0.169 C 
ENDBRANCH   1  32
TORSDOF 5