REMARK  Name = BDB055538
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.148  -0.900   0.901  0.00  0.00    +0.141 A 
ATOM      2  C   LIG    1       -1.732  -2.026   1.630  0.00  0.00    +0.112 A 
ATOM      3  C   LIG    1       -0.374  -2.181   1.956  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1        0.501  -1.156   1.601  0.00  0.00    +0.068 A 
ATOM      5  C   LIG    1        0.040  -0.083   0.853  0.00  0.00    +0.127 A 
ATOM      6  N   LIG    1       -1.258   0.038   0.516  0.00  0.00    -0.216 NA
ENDROOT
BRANCH   3   7
ATOM      7  N   LIG    1        0.096  -3.200   2.807  0.00  0.00    -0.357 N 
ATOM      8  H   LIG    1       -0.453  -4.057   2.820  0.00  0.00    +0.142 HD
ATOM      9  H   LIG    1        1.093  -3.388   2.742  0.00  0.00    +0.142 HD
ENDBRANCH   3   7
BRANCH   1  10
ATOM     10  N   LIG    1       -3.489  -0.766   0.520  0.00  0.00    -0.323 N 
ATOM     11  H   LIG    1       -4.095  -0.926   1.323  0.00  0.00    +0.148 HD
BRANCH  10  13
ATOM     12  C   LIG    1       -5.489   0.083  -0.529  0.00  0.00    +0.031 C 
ATOM     13  C   LIG    1       -3.984   0.356  -0.301  0.00  0.00    +0.025 C 
ATOM     14  C   LIG    1       -3.854   1.697   0.434  0.00  0.00    +0.031 C 
ATOM     15  C   LIG    1       -3.311   0.398  -1.681  0.00  0.00    +0.031 C 
ENDBRANCH  10  13
ENDBRANCH   1  10
BRANCH   2  16
ATOM     16  C   LIG    1       -2.686  -3.017   2.029  0.00  0.00    +0.104 C 
ATOM     17  N   LIG    1       -3.443  -3.829   2.370  0.00  0.00    -0.191 NA
ENDBRANCH   2  16
BRANCH   5  18
ATOM     18  N   LIG    1        0.869   0.971   0.459  0.00  0.00    -0.299 N 
ATOM     19  H   LIG    1        0.289   1.657  -0.018  0.00  0.00    +0.154 HD
BRANCH  18  20
ATOM     20  C   LIG    1        2.197   0.983  -0.004  0.00  0.00    +0.032 A 
ATOM     21  C   LIG    1        2.867   2.213  -0.058  0.00  0.00    +0.024 A 
ATOM     22  C   LIG    1        4.193   2.296  -0.494  0.00  0.00    +0.015 A 
ATOM     23  C   LIG    1        4.880   1.141  -0.878  0.00  0.00    +0.037 A 
ATOM     24  C   LIG    1        4.219  -0.091  -0.843  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1        2.890  -0.165  -0.404  0.00  0.00    +0.024 A 
BRANCH  23  26
ATOM     26  C   LIG    1        6.288   1.275  -1.339  0.00  0.00    +0.242 C 
ATOM     27  O   LIG    1        6.739   2.346  -1.725  0.00  0.00    -0.270 OA
ATOM     28  N   LIG    1        7.081   0.163  -1.281  0.00  0.00    -0.325 N 
ATOM     29  H   LIG    1        6.845  -0.635  -0.711  0.00  0.00    +0.145 HD
ATOM     30  H   LIG    1        8.063   0.317  -1.477  0.00  0.00    +0.145 HD
ENDBRANCH  23  26
ENDBRANCH  18  20
ENDBRANCH   5  18
TORSDOF 7