REMARK  Name = BDB026895
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.913  -0.320  -1.525  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.663  -1.669  -0.863  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.330  -1.790   0.497  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.097  -3.045   1.063  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.182  -4.194   0.280  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -1.492  -4.090  -1.074  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -1.726  -2.837  -1.643  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  N   LIG    1       -0.730   0.192  -2.283  0.00  0.00    -0.303 NA
ATOM      9  H   LIG    1       -0.955   1.156  -2.543  0.00  0.00    +0.123 HD
BRANCH   8  10
ATOM     10  C   LIG    1        0.511   0.220  -1.494  0.00  0.00    +0.086 C 
BRANCH  10  11
ATOM     11  C   LIG    1        1.607   0.976  -2.261  0.00  0.00    +0.052 C 
BRANCH  11  15
ATOM     12  C   LIG    1        5.274   0.996  -0.067  0.00  0.00    +0.119 A 
ATOM     13  N   LIG    1        5.009  -0.016  -0.915  0.00  0.00    -0.240 NA
ATOM     14  C   LIG    1        3.842   0.014  -1.599  0.00  0.00    +0.116 A 
ATOM     15  C   LIG    1        2.895   1.023  -1.486  0.00  0.00    -0.028 A 
ATOM     16  C   LIG    1        3.173   2.055  -0.595  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1        4.370   2.039   0.119  0.00  0.00    +0.044 A 
BRANCH  12  18
ATOM     18  N   LIG    1        6.460   1.014   0.690  0.00  0.00    -0.329 N 
ATOM     19  H   LIG    1        6.908   1.914   0.545  0.00  0.00    +0.147 HD
BRANCH  18  21
ATOM     20  C   LIG    1        6.992  -1.322   1.250  0.00  0.00    +0.024 C 
ATOM     21  C   LIG    1        7.386  -0.090   0.450  0.00  0.00    +0.099 C 
ENDBRANCH  18  21
ENDBRANCH  12  18
ENDBRANCH  11  15
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   1  22
ATOM     22  C   LIG    1       -2.515   0.779  -0.603  0.00  0.00    +0.186 C 
ATOM     23  O   LIG    1       -1.927   1.854  -0.441  0.00  0.00    -0.290 OA
BRANCH  22  24
ATOM     24  C   LIG    1       -3.829   0.551   0.024  0.00  0.00    +0.044 A 
ATOM     25  C   LIG    1       -4.489   1.396   0.983  0.00  0.00    +0.010 A 
ATOM     26  C   LIG    1       -5.706   0.796   1.310  0.00  0.00    +0.047 A 
ATOM     27  C   LIG    1       -6.607   1.352   2.226  0.00  0.00    +0.026 A 
ATOM     28  C   LIG    1       -6.255   2.562   2.831  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1       -5.050   3.188   2.529  0.00  0.00    +0.001 A 
ATOM     30  N   LIG    1       -5.794  -0.364   0.581  0.00  0.00    -0.360 N 
ATOM     31  H   LIG    1       -6.573  -1.007   0.621  0.00  0.00    +0.165 HD
ATOM     32  C   LIG    1       -4.161   2.617   1.611  0.00  0.00    +0.011 A 
ATOM     33  C   LIG    1       -4.680  -0.518  -0.200  0.00  0.00    +0.095 A 
ENDBRANCH  22  24
ENDBRANCH   1  22
TORSDOF 9