REMARK  Name = BDB026327
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.291  -0.322   2.661  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1       -0.757  -1.452   1.827  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -0.952  -1.109   0.333  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1       -1.895   0.023   0.145  0.00  0.00    -0.324 N 
ATOM      5  C   LIG    1       -1.900   1.006   1.260  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1       -0.561   0.984   2.034  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.188  -0.247  -0.341  0.00  0.00    +0.085 A 
ATOM      8  C   LIG    1       -3.890  -1.460  -0.219  0.00  0.00    +0.235 A 
ATOM      9  F   LIG    1       -3.336  -2.475   0.465  0.00  0.00    -0.182 F 
ATOM     10  N   LIG    1       -5.134  -1.697  -0.693  0.00  0.00    -0.213 NA
ATOM     11  C   LIG    1       -5.737  -0.678  -1.343  0.00  0.00    +0.129 A 
ATOM     12  C   LIG    1       -5.148   0.566  -1.530  0.00  0.00    +0.035 A 
ATOM     13  C   LIG    1       -3.868   0.775  -1.019  0.00  0.00    +0.030 A 
BRANCH  11  14
ATOM     14  C   LIG    1       -7.116  -0.951  -1.867  0.00  0.00    +0.262 C 
ATOM     15  N   LIG    1       -8.020   0.098  -1.763  0.00  0.00    -0.313 N 
ATOM     16  H   LIG    1       -7.800   0.860  -1.136  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1       -9.405  -0.100  -2.111  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1       -7.410  -2.042  -2.343  0.00  0.00    -0.269 OA
ENDBRANCH  11  14
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1        1.092  -0.476   3.141  0.00  0.00    +0.140 C 
BRANCH  19  29
ATOM     20  C   LIG    1        5.988   0.550  -1.060  0.00  0.00    +0.017 A 
ATOM     21  C   LIG    1        5.753   1.797  -0.261  0.00  0.00    +0.252 A 
ATOM     22  O   LIG    1        6.419   2.813  -0.430  0.00  0.00    -0.268 OA
ATOM     23  N   LIG    1        4.753   1.756   0.675  0.00  0.00    -0.322 N 
ATOM     24  H   LIG    1        4.619   2.607   1.205  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1        3.957   0.630   0.915  0.00  0.00    +0.052 A 
ATOM     26  C   LIG    1        4.173  -0.522   0.165  0.00  0.00    +0.017 A 
ATOM     27  C   LIG    1        3.361  -1.611   0.434  0.00  0.00    +0.121 A 
ATOM     28  N   LIG    1        2.383  -1.611   1.372  0.00  0.00    -0.258 NA
ATOM     29  C   LIG    1        2.194  -0.473   2.091  0.00  0.00    +0.057 A 
ATOM     30  C   LIG    1        2.966   0.669   1.890  0.00  0.00    +0.051 A 
ATOM     31  C   LIG    1        5.221  -0.535  -0.852  0.00  0.00    +0.020 A 
BRANCH  20  33
ATOM     32  C   LIG    1        8.461   0.451  -1.497  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1        7.072   0.600  -2.102  0.00  0.00    +0.037 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 5