REMARK  Name = BDB026415
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.518   0.465   0.648  0.00  0.00    -0.279 N 
ATOM      2  C   LIG    1       -1.579   0.627  -0.364  0.00  0.00    +0.306 C 
ATOM      3  O   LIG    1       -1.294   1.669  -0.931  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1       -1.025  -0.628  -0.631  0.00  0.00    -0.276 N 
ATOM      5  C   LIG    1       -1.522  -1.643   0.308  0.00  0.00    +0.049 C 
ATOM      6  C   LIG    1       -0.515  -1.911   1.436  0.00  0.00    +0.033 C 
ATOM      7  C   LIG    1       -1.912  -2.954  -0.377  0.00  0.00    +0.033 C 
ATOM      8  C   LIG    1       -2.769  -0.940   0.895  0.00  0.00    +0.135 C 
ENDROOT
BRANCH   1   9
ATOM      9  C   LIG    1       -3.438   1.510   1.050  0.00  0.00    +0.146 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -8.514   1.200  -1.651  0.00  0.00    +0.065 C 
ATOM     11  C   LIG    1       -7.179   1.296  -0.976  0.00  0.00    +0.038 A 
ATOM     12  N   LIG    1       -7.112   0.930   0.325  0.00  0.00    -0.260 NA
ATOM     13  C   LIG    1       -5.908   1.020   0.934  0.00  0.00    +0.116 A 
ATOM     14  C   LIG    1       -4.745   1.456   0.310  0.00  0.00    -0.012 A 
ATOM     15  C   LIG    1       -4.842   1.825  -1.033  0.00  0.00    +0.008 A 
ATOM     16  C   LIG    1       -6.070   1.746  -1.685  0.00  0.00    +0.023 A 
ENDBRANCH   9  14
ENDBRANCH   1   9
BRANCH   4  17
ATOM     17  C   LIG    1       -0.023  -0.834  -1.666  0.00  0.00    +0.142 C 
BRANCH  17  18
ATOM     18  C   LIG    1        1.449  -0.831  -1.209  0.00  0.00    +0.146 C 
BRANCH  18  19
ATOM     19  O   LIG    1        2.253  -1.115  -2.368  0.00  0.00    -0.389 OA
ATOM     20  H   LIG    1        2.230  -0.326  -2.938  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1        1.882   0.511  -0.564  0.00  0.00    +0.117 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.184   0.564   0.131  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        4.334   0.238  -0.724  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        5.658   0.346   0.009  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1        5.713   0.240   1.411  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        6.950   0.300   2.066  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        8.128   0.440   1.333  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        8.079   0.525  -0.057  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        4.437   0.130   2.208  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1        6.851   0.475  -0.717  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        3.222  -0.253   1.348  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 7