REMARK  Name = BDB000290
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.017  -0.093   0.265  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1        0.673   0.141  -0.088  0.00  0.00    +0.036 A 
ATOM      3  C   LIG    1       -0.327  -0.814   0.148  0.00  0.00    +0.079 A 
ATOM      4  N   LIG    1       -1.683  -0.621  -0.242  0.00  0.00    -0.263 N 
ATOM      5  C   LIG    1       -2.665  -1.506   0.196  0.00  0.00    +0.263 C 
ATOM      6  C   LIG    1       -2.193  -2.575   1.205  0.00  0.00    +0.181 C 
ATOM      7  O   LIG    1       -0.842  -3.011   1.073  0.00  0.00    -0.475 OA
ATOM      8  C   LIG    1       -3.056  -3.832   1.032  0.00  0.00    +0.065 C 
ATOM      9  C   LIG    1       -2.397  -2.024   2.626  0.00  0.00    +0.065 C 
ATOM     10  O   LIG    1       -3.856  -1.378  -0.101  0.00  0.00    -0.271 OA
ATOM     11  C   LIG    1        0.040  -2.009   0.779  0.00  0.00    +0.143 A 
ATOM     12  C   LIG    1        1.368  -2.264   1.122  0.00  0.00    +0.048 A 
ATOM     13  C   LIG    1        2.351  -1.310   0.871  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  15
ATOM     14  C   LIG    1        3.914   0.890  -1.075  0.00  0.00    +0.056 A 
ATOM     15  C   LIG    1        3.042   0.928   0.011  0.00  0.00    +0.043 A 
ATOM     16  C   LIG    1        3.205   2.035   0.845  0.00  0.00    +0.129 A 
ATOM     17  N   LIG    1        4.118   2.996   0.639  0.00  0.00    -0.199 NA
ATOM     18  C   LIG    1        4.920   2.846  -0.412  0.00  0.00    +0.214 A 
ATOM     19  N   LIG    1        4.852   1.844  -1.287  0.00  0.00    -0.219 NA
BRANCH  16  20
ATOM     20  N   LIG    1        2.372   2.249   1.951  0.00  0.00    -0.343 N 
ATOM     21  H   LIG    1        2.341   1.437   2.557  0.00  0.00    +0.144 HD
ATOM     22  H   LIG    1        2.721   3.073   2.434  0.00  0.00    +0.144 HD
ENDBRANCH  16  20
BRANCH  18  23
ATOM     23  N   LIG    1        5.864   3.825  -0.643  0.00  0.00    -0.327 N 
ATOM     24  H   LIG    1        5.560   4.696  -0.229  0.00  0.00    +0.145 HD
ATOM     25  H   LIG    1        6.104   3.838  -1.624  0.00  0.00    +0.145 HD
ENDBRANCH  18  23
BRANCH  14  27
ATOM     26  C   LIG    1        4.976  -1.244  -1.860  0.00  0.00    +0.010 C 
ATOM     27  C   LIG    1        3.890  -0.210  -2.110  0.00  0.00    +0.053 C 
ENDBRANCH  14  27
ENDBRANCH   1  15
BRANCH   4  28
ATOM     28  C   LIG    1       -2.073   0.477  -1.138  0.00  0.00    +0.132 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -2.663   1.673  -0.374  0.00  0.00    +0.123 C 
BRANCH  29  30
ATOM     30  N   LIG    1       -4.069   1.481  -0.062  0.00  0.00    -0.314 N 
ATOM     31  H   LIG    1       -4.290   0.683   0.527  0.00  0.00    +0.149 HD
ATOM     32  C   LIG    1       -5.033   1.806  -0.993  0.00  0.00    +0.210 C 
ATOM     33  O   LIG    1       -4.797   2.407  -2.035  0.00  0.00    -0.276 OA
ATOM     34  C   LIG    1       -6.417   1.338  -0.630  0.00  0.00    +0.109 C 
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH   4  28
TORSDOF 7