REMARK  Name = BDB014880
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.881   6.391  -0.247  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1        2.618   5.077  -0.212  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1        1.857   3.915  -0.230  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1        2.620   2.653  -0.288  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1        1.754   1.492   0.046  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        2.064   0.118   0.240  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1        0.951  -0.575   0.508  0.00  0.00    -0.155 NA
ATOM      8  N   LIG    1       -0.043   0.328   0.503  0.00  0.00    -0.266 N 
ATOM      9  C   LIG    1        0.389   1.582   0.214  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -0.397   2.832   0.112  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1        0.439   3.876  -0.658  0.00  0.00    +0.114 C 
ATOM     12  O   LIG    1        3.848   5.060  -0.159  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   6  13
ATOM     13  N   LIG    1        3.334  -0.349   0.146  0.00  0.00    -0.298 N 
ATOM     14  H   LIG    1        4.067   0.330  -0.019  0.00  0.00    +0.154 HD
BRANCH  13  15
ATOM     15  C   LIG    1        3.871  -1.651   0.273  0.00  0.00    +0.033 A 
ATOM     16  C   LIG    1        5.264  -1.818   0.149  0.00  0.00    +0.026 A 
ATOM     17  C   LIG    1        5.872  -3.079   0.268  0.00  0.00    -0.049 A 
ATOM     18  C   LIG    1        7.355  -3.224   0.099  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1        5.070  -4.200   0.489  0.00  0.00    +0.003 A 
ATOM     20  C   LIG    1        3.691  -4.056   0.614  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        3.100  -2.793   0.508  0.00  0.00    +0.023 A 
ENDBRANCH  13  15
ENDBRANCH   6  13
BRANCH   8  22
ATOM     22  C   LIG    1       -1.398  -0.108   0.790  0.00  0.00    +0.144 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.115  -0.595  -0.470  0.00  0.00    +0.028 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -3.514  -1.175  -0.191  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -4.489  -0.112   0.355  0.00  0.00    +0.087 C 
ATOM     26  N   LIG    1       -5.866  -0.586   0.542  0.00  0.00    -0.305 NA
ATOM     27  C   LIG    1       -6.001  -1.467   1.700  0.00  0.00    +0.104 C 
ATOM     28  C   LIG    1       -6.397  -1.195  -0.684  0.00  0.00    +0.084 C 
ATOM     29  C   LIG    1       -5.508  -2.295  -1.265  0.00  0.00    +0.016 C 
ATOM     30  C   LIG    1       -4.082  -1.798  -1.476  0.00  0.00    +0.006 C 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH   8  22
TORSDOF 5