REMARK  Name = BDB065107
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.102   0.833  -1.807  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1        1.110   0.700  -0.842  0.00  0.00    +0.164 A 
ATOM      3  C   LIG    1        0.774   0.265   0.442  0.00  0.00    +0.077 A 
ATOM      4  C   LIG    1       -0.534  -0.027   0.802  0.00  0.00    +0.078 A 
ATOM      5  C   LIG    1       -1.570   0.132  -0.145  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1       -2.908  -0.150   0.267  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1       -3.103  -0.645   1.556  0.00  0.00    +0.062 A 
ATOM      8  C   LIG    1       -2.014  -0.772   2.402  0.00  0.00    +0.142 A 
ATOM      9  N   LIG    1       -0.750  -0.458   2.051  0.00  0.00    -0.236 NA
ATOM     10  C   LIG    1       -1.221   0.552  -1.453  0.00  0.00    +0.061 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -0.447   1.194  -4.105  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1        0.502   1.253  -3.050  0.00  0.00    -0.491 OA
ENDBRANCH   1  12
BRANCH   8  13
ATOM     13  C   LIG    1       -2.189  -1.255   3.744  0.00  0.00    +0.119 C 
ATOM     14  N   LIG    1       -2.379  -1.646   4.822  0.00  0.00    -0.189 NA
ENDBRANCH   8  13
BRANCH   6  15
ATOM     15  N   LIG    1       -3.962   0.001  -0.652  0.00  0.00    -0.340 N 
ATOM     16  H   LIG    1       -3.849   0.874  -1.167  0.00  0.00    +0.146 HD
BRANCH  15  17
ATOM     17  C   LIG    1       -5.369  -0.274  -0.323  0.00  0.00    +0.073 C 
ATOM     18  C   LIG    1       -6.286   0.493  -1.299  0.00  0.00    +0.037 C 
ATOM     19  C   LIG    1       -7.545  -0.291  -1.673  0.00  0.00    +0.082 C 
ATOM     20  N   LIG    1       -8.075  -1.042  -0.542  0.00  0.00    -0.316 NA
ATOM     21  H   LIG    1       -8.323  -0.402   0.213  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1       -7.126  -2.047  -0.053  0.00  0.00    +0.082 C 
ATOM     23  C   LIG    1       -5.663  -1.772  -0.410  0.00  0.00    +0.037 C 
ENDBRANCH  15  17
ENDBRANCH   6  15
BRANCH   2  24
ATOM     24  O   LIG    1        2.385   1.003  -1.253  0.00  0.00    -0.488 OA
BRANCH  24  25
ATOM     25  C   LIG    1        3.438   0.902  -0.291  0.00  0.00    +0.230 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.737   1.303  -0.978  0.00  0.00    +0.056 C 
BRANCH  26  27
ATOM     27  C   LIG    1        5.928   1.499  -0.036  0.00  0.00    +0.087 C 
BRANCH  27  28
ATOM     28  N   LIG    1        6.313   0.280   0.680  0.00  0.00    -0.302 NA
ATOM     29  C   LIG    1        7.760   0.224   0.923  0.00  0.00    +0.084 C 
ATOM     30  C   LIG    1        7.899  -0.883   1.957  0.00  0.00    +0.017 C 
ATOM     31  C   LIG    1        6.558  -0.919   2.678  0.00  0.00    +0.017 C 
ATOM     32  C   LIG    1        5.727   0.174   2.021  0.00  0.00    +0.084 C 
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH   2  24
TORSDOF 9