REMARK  Name = BDB002377
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.010   0.629   0.698  0.00  0.00    +0.237 C 
ATOM      2  N   LIG    1        0.145   0.696   1.446  0.00  0.00    -0.288 N 
ATOM      3  C   LIG    1        1.428   0.932   0.797  0.00  0.00    +0.162 C 
ATOM      4  C   LIG    1        2.330   1.442   1.923  0.00  0.00    +0.033 C 
ATOM      5  C   LIG    1        1.753   0.764   3.163  0.00  0.00    +0.021 C 
ATOM      6  C   LIG    1        0.256   0.764   2.893  0.00  0.00    +0.109 C 
ATOM      7  O   LIG    1       -0.981   0.778  -0.529  0.00  0.00    -0.274 OA
ENDROOT
BRANCH   3   8
ATOM      8  C   LIG    1        2.003  -0.372   0.188  0.00  0.00    +0.238 C 
ATOM      9  N   LIG    1        2.974  -0.113  -0.774  0.00  0.00    -0.283 N 
ATOM     10  H   LIG    1        3.103   0.859  -1.009  0.00  0.00    +0.155 HD
ATOM     11  O   LIG    1        1.659  -1.480   0.591  0.00  0.00    -0.273 OA
BRANCH   9  12
ATOM     12  C   LIG    1        3.751  -1.047  -1.513  0.00  0.00    +0.044 A 
ATOM     13  C   LIG    1        4.697  -0.573  -2.470  0.00  0.00    +0.022 A 
ATOM     14  C   LIG    1        5.441  -1.551  -3.170  0.00  0.00    +0.073 A 
ATOM     15  C   LIG    1        6.379  -1.151  -4.113  0.00  0.00    +0.028 A 
ATOM     16  C   LIG    1        6.619   0.193  -4.398  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1        5.903   1.169  -3.726  0.00  0.00    +0.001 A 
ATOM     18  N   LIG    1        5.295  -2.868  -2.975  0.00  0.00    -0.252 NA
ATOM     19  C   LIG    1        4.393  -3.293  -2.067  0.00  0.00    +0.041 A 
ATOM     20  C   LIG    1        4.252  -4.774  -1.879  0.00  0.00    +0.065 C 
ATOM     21  C   LIG    1        4.953   0.794  -2.774  0.00  0.00    +0.012 A 
ATOM     22  C   LIG    1        3.613  -2.421  -1.323  0.00  0.00    +0.047 A 
ENDBRANCH   9  12
ENDBRANCH   3   8
BRANCH   1  23
ATOM     23  C   LIG    1       -2.327   0.300   1.440  0.00  0.00    +0.162 C 
BRANCH  23  25
ATOM     24  C   LIG    1       -3.878   2.124   0.811  0.00  0.00    +0.230 C 
ATOM     25  N   LIG    1       -3.438   0.826   0.658  0.00  0.00    -0.302 N 
ATOM     26  H   LIG    1       -3.591   0.445  -0.272  0.00  0.00    +0.150 HD
ATOM     27  O   LIG    1       -3.530   2.844   1.743  0.00  0.00    -0.274 OA
BRANCH  24  28
ATOM     28  C   LIG    1       -4.782   2.607  -0.349  0.00  0.00    +0.137 C 
ATOM     29  C   LIG    1       -5.575   3.856   0.027  0.00  0.00    +0.034 C 
BRANCH  28  31
ATOM     30  C   LIG    1       -6.662   1.059   0.022  0.00  0.00    +0.101 C 
ATOM     31  N   LIG    1       -5.615   1.503  -0.894  0.00  0.00    -0.309 NA
ATOM     32  H   LIG    1       -6.059   1.832  -1.752  0.00  0.00    +0.122 HD
ENDBRANCH  28  31
ENDBRANCH  24  28
ENDBRANCH  23  25
BRANCH  23  33
ATOM     33  C   LIG    1       -2.455  -1.220   1.697  0.00  0.00    +0.012 C 
ATOM     34  C   LIG    1       -3.623  -1.513   2.644  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1       -2.604  -2.050   0.417  0.00  0.00    +0.009 C 
ENDBRANCH  23  33
ENDBRANCH   1  23
TORSDOF 7