REMARK  Name = BDB032455
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.297  -1.724  -0.626  0.00  0.00    -0.026 A 
ATOM      2  C   LIG    1       -0.084  -1.034  -0.519  0.00  0.00    +0.048 A 
ATOM      3  C   LIG    1        1.004  -1.630   0.116  0.00  0.00    +0.119 A 
ATOM      4  N   LIG    1        0.914  -2.858   0.664  0.00  0.00    -0.241 NA
ATOM      5  C   LIG    1       -0.264  -3.513   0.562  0.00  0.00    +0.113 A 
ATOM      6  C   LIG    1       -1.382  -2.998  -0.065  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   3   7
ATOM      7  N   LIG    1        2.192  -0.880   0.221  0.00  0.00    -0.329 N 
ATOM      8  H   LIG    1        2.435  -0.546  -0.715  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1        3.323  -1.629   0.773  0.00  0.00    +0.112 C 
BRANCH   9  10
ATOM     10  C   LIG    1        4.529  -0.710   0.958  0.00  0.00    +0.114 C 
BRANCH  10  11
ATOM     11  C   LIG    1        5.108  -0.235  -0.362  0.00  0.00    +0.217 C 
ATOM     12  N   LIG    1        6.230   0.562  -0.277  0.00  0.00    -0.301 N 
ATOM     13  C   LIG    1        6.857   1.115  -1.464  0.00  0.00    +0.108 C 
ATOM     14  C   LIG    1        7.792   2.192  -0.932  0.00  0.00    +0.020 C 
ATOM     15  C   LIG    1        8.187   1.653   0.437  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1        6.901   1.009   0.934  0.00  0.00    +0.108 C 
ATOM     17  O   LIG    1        4.600  -0.526  -1.446  0.00  0.00    -0.276 OA
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   7   9
ENDBRANCH   3   7
BRANCH   1  18
ATOM     18  C   LIG    1       -2.493  -1.096  -1.294  0.00  0.00    +0.137 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -3.470  -0.743  -0.273  0.00  0.00    -0.339 N 
ATOM     20  H   LIG    1       -3.019  -0.309   0.529  0.00  0.00    +0.146 HD
BRANCH  19  24
ATOM     21  C   LIG    1       -7.507   1.622   1.131  0.00  0.00    +0.124 A 
ATOM     22  C   LIG    1       -6.707   1.115   0.082  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1       -5.511   0.434   0.420  0.00  0.00    +0.008 A 
ATOM     24  C   LIG    1       -4.653  -0.059  -0.615  0.00  0.00    +0.035 A 
ATOM     25  C   LIG    1       -5.077   0.058  -1.949  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1       -6.261   0.711  -2.280  0.00  0.00    +0.003 A 
ATOM     27  C   LIG    1       -5.237   0.267   1.791  0.00  0.00    +0.030 A 
ATOM     28  C   LIG    1       -6.106   0.783   2.737  0.00  0.00    +0.113 A 
ATOM     29  C   LIG    1       -7.061   1.244  -1.277  0.00  0.00    +0.012 A 
ATOM     30  N   LIG    1       -7.224   1.465   2.435  0.00  0.00    -0.240 NA
BRANCH  21  31
ATOM     31  N   LIG    1       -8.685   2.338   0.884  0.00  0.00    -0.343 N 
ATOM     32  H   LIG    1       -9.040   2.609   1.798  0.00  0.00    +0.144 HD
ATOM     33  H   LIG    1       -8.490   3.149   0.309  0.00  0.00    +0.144 HD
ENDBRANCH  21  31
ENDBRANCH  19  24
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 8