REMARK  Name = BDB026429
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.777  -0.538  -0.787  0.00  0.00    -0.220 N 
ATOM      2  C   LIG    1        1.782  -0.786   0.108  0.00  0.00    +0.312 C 
ATOM      3  O   LIG    1        1.622  -1.796   0.777  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1        0.916   0.290   0.102  0.00  0.00    -0.274 N 
ATOM      5  C   LIG    1        1.278   1.260  -0.903  0.00  0.00    +0.205 C 
ATOM      6  C   LIG    1        2.557   0.640  -1.441  0.00  0.00    +0.241 C 
ATOM      7  O   LIG    1        3.243   1.125  -2.331  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   1   8
ATOM      8  C   LIG    1        3.893  -1.420  -1.032  0.00  0.00    +0.153 C 
BRANCH   8  13
ATOM      9  C   LIG    1        8.359  -0.047   2.451  0.00  0.00    +0.044 C 
ATOM     10  C   LIG    1        7.227  -0.427   1.543  0.00  0.00    -0.050 A 
ATOM     11  C   LIG    1        6.241  -1.323   1.972  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        5.170  -1.651   1.137  0.00  0.00    +0.005 A 
ATOM     13  C   LIG    1        5.065  -1.086  -0.141  0.00  0.00    -0.030 A 
ATOM     14  C   LIG    1        6.038  -0.168  -0.558  0.00  0.00    +0.005 A 
ATOM     15  C   LIG    1        7.109   0.159   0.278  0.00  0.00    +0.003 A 
ENDBRANCH   8  13
ENDBRANCH   1   8
BRANCH   4  16
ATOM     16  C   LIG    1       -0.333   0.370   0.854  0.00  0.00    +0.142 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -1.409  -0.590   0.306  0.00  0.00    +0.146 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -1.172  -1.929   0.771  0.00  0.00    -0.389 OA
ATOM     19  H   LIG    1       -0.202  -2.077   0.796  0.00  0.00    +0.210 HD
ENDBRANCH  17  18
BRANCH  17  20
ATOM     20  C   LIG    1       -2.827  -0.184   0.768  0.00  0.00    +0.117 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.248   1.163   0.334  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1       -3.601   1.218  -1.099  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1       -4.951   0.635  -1.457  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1       -5.964   0.505  -0.489  0.00  0.00    -0.042 A 
ATOM     25  C   LIG    1       -7.217  -0.004  -0.856  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1       -7.472  -0.361  -2.180  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -6.479  -0.215  -3.145  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -5.684   0.850   0.952  0.00  0.00    +0.051 C 
ATOM     29  C   LIG    1       -5.226   0.284  -2.788  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1       -4.390   1.659   1.125  0.00  0.00    +0.089 C 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH  16  17
ENDBRANCH   4  16
TORSDOF 7