REMARK  Name = BDB005010
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.478  -3.005   2.884  0.00  0.00    +0.033 C 
ATOM      2  C   LIG    1        0.077  -1.770   2.072  0.00  0.00    +0.099 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -0.485  -1.995   0.675  0.00  0.00    -0.026 A 
ATOM      4  C   LIG    1       -1.273  -0.982   0.089  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1       -1.803  -1.120  -1.196  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -1.552  -2.297  -1.906  0.00  0.00    +0.023 A 
ATOM      7  C   LIG    1       -0.778  -3.312  -1.344  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -0.245  -3.161  -0.063  0.00  0.00    +0.005 A 
BRANCH   5   9
ATOM      9  N   LIG    1       -2.587  -0.136  -1.829  0.00  0.00    -0.285 N 
ATOM     10  H   LIG    1       -2.930  -0.364  -2.753  0.00  0.00    +0.155 HD
ATOM     11  C   LIG    1       -2.920   1.111  -1.349  0.00  0.00    +0.221 C 
ATOM     12  O   LIG    1       -2.562   1.633  -0.304  0.00  0.00    -0.275 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -3.788   1.886  -2.283  0.00  0.00    +0.081 C 
ATOM     14  C   LIG    1       -5.192   2.319  -1.875  0.00  0.00    -0.023 C 
ATOM     15  C   LIG    1       -5.642   3.696  -2.290  0.00  0.00    +0.011 C 
ATOM     16  C   LIG    1       -5.758   1.866  -0.552  0.00  0.00    +0.011 C 
ATOM     17  C   LIG    1       -5.001   1.276  -2.950  0.00  0.00    +0.020 C 
ENDBRANCH  11  13
ENDBRANCH   5   9
ENDBRANCH   2   3
BRANCH   2  18
ATOM     18  N   LIG    1        1.111  -0.723   2.088  0.00  0.00    -0.322 N 
ATOM     19  H   LIG    1        0.721   0.137   1.709  0.00  0.00    +0.148 HD
BRANCH  18  20
ATOM     20  C   LIG    1        2.362  -0.930   1.478  0.00  0.00    +0.130 A 
ATOM     21  C   LIG    1        3.310   0.119   1.482  0.00  0.00    +0.041 A 
ATOM     22  C   LIG    1        4.539  -0.133   0.839  0.00  0.00    +0.088 A 
ATOM     23  C   LIG    1        5.489   0.909   0.812  0.00  0.00    +0.063 A 
ATOM     24  C   LIG    1        5.228   2.156   1.411  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1        4.025   2.390   2.055  0.00  0.00    +0.002 A 
ATOM     26  N   LIG    1        4.780  -1.337   0.273  0.00  0.00    -0.235 NA
ATOM     27  C   LIG    1        3.823  -2.267   0.355  0.00  0.00    +0.223 A 
ATOM     28  C   LIG    1        3.076   1.377   2.094  0.00  0.00    +0.013 A 
ATOM     29  N   LIG    1        2.635  -2.123   0.936  0.00  0.00    -0.220 NA
BRANCH  23  30
ATOM     30  C   LIG    1        6.827   0.780   0.154  0.00  0.00    +0.244 C 
ATOM     31  O   LIG    1        7.565   1.749   0.004  0.00  0.00    -0.270 OA
ATOM     32  N   LIG    1        7.222  -0.449  -0.283  0.00  0.00    -0.325 N 
ATOM     33  H   LIG    1        8.078  -0.520  -0.814  0.00  0.00    +0.145 HD
ATOM     34  H   LIG    1        6.564  -1.223  -0.290  0.00  0.00    +0.145 HD
ENDBRANCH  23  30
ENDBRANCH  18  20
ENDBRANCH   2  18
TORSDOF 6