REMARK  Name = BDB028200
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.417   0.072   0.150  0.00  0.00    +0.083 A 
ATOM      2  C   LIG    1       -3.014  -0.251   0.520  0.00  0.00    +0.012 A 
ATOM      3  C   LIG    1       -2.813  -1.355   1.344  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -1.523  -1.728   1.730  0.00  0.00    +0.014 A 
ATOM      5  C   LIG    1       -0.424  -0.989   1.287  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -0.596   0.132   0.460  0.00  0.00    -0.016 A 
ATOM      7  C   LIG    1       -3.975  -2.126   1.812  0.00  0.00    +0.272 A 
ATOM      8  O   LIG    1       -3.840  -3.107   2.536  0.00  0.00    -0.266 OA
ATOM      9  N   LIG    1       -5.204  -1.678   1.398  0.00  0.00    -0.242 N 
ATOM     10  H   LIG    1       -6.019  -2.202   1.699  0.00  0.00    +0.192 HD
ATOM     11  C   LIG    1       -1.905   0.491   0.084  0.00  0.00    +0.019 A 
ATOM     12  N   LIG    1       -5.435  -0.615   0.582  0.00  0.00    -0.174 NA
ENDROOT
BRANCH   6  13
ATOM     13  C   LIG    1        0.562   0.908  -0.007  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1        1.639   0.300  -0.666  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1        2.729   1.059  -1.108  0.00  0.00    -0.028 A 
ATOM     16  C   LIG    1        2.700   2.426  -0.859  0.00  0.00    +0.114 A 
ATOM     17  N   LIG    1        1.685   3.059  -0.231  0.00  0.00    -0.262 NA
ATOM     18  C   LIG    1        0.652   2.287   0.180  0.00  0.00    +0.119 A 
BRANCH  15  19
ATOM     19  C   LIG    1        3.902   0.419  -1.799  0.00  0.00    +0.040 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.880  -0.111  -0.792  0.00  0.00    -0.007 C 
ATOM     21  C   LIG    1        5.884  -1.158  -1.205  0.00  0.00    +0.004 C 
ATOM     22  C   LIG    1        4.767  -1.520  -0.266  0.00  0.00    +0.004 C 
ENDBRANCH  19  20
ENDBRANCH  15  19
ENDBRANCH   6  13
BRANCH   1  23
ATOM     23  C   LIG    1       -4.710   1.255  -0.773  0.00  0.00    +0.136 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.482   0.870  -2.167  0.00  0.00    -0.325 NA
ATOM     25  H   LIG    1       -3.495   0.708  -2.348  0.00  0.00    +0.119 HD
ATOM     26  H   LIG    1       -4.772   1.631  -2.779  0.00  0.00    +0.119 HD
ENDBRANCH  23  24
ENDBRANCH   1  23
TORSDOF 5