REMARK  Name = BDB051305
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.493  -1.169  -0.795  0.00  0.00    -0.021 A 
ATOM      2  C   LIG    1       -2.808  -0.780  -0.330  0.00  0.00    +0.007 A 
ATOM      3  C   LIG    1       -3.705  -1.738  -0.815  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -5.075  -1.726  -0.539  0.00  0.00    +0.027 A 
ATOM      5  C   LIG    1       -5.562  -0.705   0.272  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1       -4.707   0.283   0.766  0.00  0.00    +0.041 A 
ATOM      7  C   LIG    1       -5.300   1.343   1.637  0.00  0.00    +0.244 C 
ATOM      8  O   LIG    1       -6.458   1.290   2.033  0.00  0.00    -0.270 OA
ATOM      9  N   LIG    1       -4.487   2.395   1.982  0.00  0.00    -0.311 N 
ATOM     10  H   LIG    1       -4.971   3.148   2.455  0.00  0.00    +0.149 HD
ATOM     11  C   LIG    1       -3.271   2.662   1.257  0.00  0.00    +0.109 C 
ATOM     12  C   LIG    1       -2.463   1.388   1.049  0.00  0.00    +0.055 C 
ATOM     13  N   LIG    1       -2.988  -2.634  -1.570  0.00  0.00    -0.360 N 
ATOM     14  H   LIG    1       -3.390  -3.428  -2.049  0.00  0.00    +0.165 HD
ATOM     15  C   LIG    1       -3.319   0.286   0.465  0.00  0.00    -0.024 A 
ATOM     16  C   LIG    1       -1.664  -2.302  -1.568  0.00  0.00    +0.087 A 
ENDROOT
BRANCH   1  17
ATOM     17  C   LIG    1       -0.193  -0.471  -0.499  0.00  0.00    +0.052 C 
BRANCH  17  18
ATOM     18  C   LIG    1        1.071  -1.277  -0.838  0.00  0.00    +0.086 C 
BRANCH  18  19
ATOM     19  N   LIG    1        2.276  -0.534  -0.451  0.00  0.00    -0.312 NA
ATOM     20  H   LIG    1        2.269  -0.368   0.555  0.00  0.00    +0.122 HD
BRANCH  19  21
ATOM     21  C   LIG    1        3.484  -1.283  -0.792  0.00  0.00    +0.119 C 
BRANCH  21  26
ATOM     22  C   LIG    1        7.025   2.206  -0.073  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1        6.217   1.014  -0.003  0.00  0.00    -0.274 N 
ATOM     24  N   LIG    1        6.555   0.032   0.851  0.00  0.00    -0.180 NA
ATOM     25  C   LIG    1        5.610  -0.890   0.659  0.00  0.00    +0.139 A 
ATOM     26  C   LIG    1        4.661  -0.508  -0.318  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        5.098   0.737  -0.730  0.00  0.00    +0.112 A 
ENDBRANCH  21  26
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 5