REMARK  Name = BDB027518
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.594   1.985  -0.399  0.00  0.00    +0.247 C 
ATOM      2  N   LIG    1       -0.548   1.089  -0.614  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1        0.808   1.637  -0.692  0.00  0.00    +0.130 C 
ATOM      4  C   LIG    1        1.895   0.569  -0.460  0.00  0.00    +0.090 C 
ATOM      5  C   LIG    1        1.752  -0.583  -1.474  0.00  0.00    +0.025 C 
ATOM      6  C   LIG    1        0.328  -0.752  -2.010  0.00  0.00    +0.021 C 
ATOM      7  C   LIG    1       -0.727  -0.313  -1.001  0.00  0.00    +0.108 C 
ATOM      8  O   LIG    1       -1.442   3.205  -0.390  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -5.580   0.541   0.265  0.00  0.00    +0.034 A 
ATOM     10  C   LIG    1       -5.324   1.548  -0.678  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -4.022   2.011  -0.892  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1       -2.961   1.461  -0.170  0.00  0.00    +0.037 A 
ATOM     13  C   LIG    1       -3.209   0.482   0.794  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -4.513   0.018   1.002  0.00  0.00    +0.024 A 
BRANCH   9  16
ATOM     15  C   LIG    1       -7.402  -0.861   1.249  0.00  0.00    +0.241 C 
ATOM     16  N   LIG    1       -6.921   0.130   0.417  0.00  0.00    -0.282 N 
ATOM     17  H   LIG    1       -7.593   0.618  -0.160  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -6.753  -1.582   1.995  0.00  0.00    -0.271 OA
BRANCH  15  20
ATOM     19  C   LIG    1       -9.537  -1.921   1.865  0.00  0.00    +0.013 C 
ATOM     20  C   LIG    1       -8.885  -0.996   1.148  0.00  0.00    +0.060 C 
ENDBRANCH  15  20
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   4  21
ATOM     21  N   LIG    1        3.216   1.182  -0.551  0.00  0.00    -0.309 N 
ATOM     22  H   LIG    1        3.470   1.584  -1.447  0.00  0.00    +0.149 HD
BRANCH  21  23
ATOM     23  C   LIG    1        4.295   0.449  -0.098  0.00  0.00    +0.217 A 
ATOM     24  N   LIG    1        5.458   0.697  -0.711  0.00  0.00    -0.197 NA
ATOM     25  C   LIG    1        6.523   0.006  -0.274  0.00  0.00    +0.146 A 
ATOM     26  C   LIG    1        6.484  -0.929   0.743  0.00  0.00    +0.036 A 
ATOM     27  C   LIG    1        7.691  -1.634   1.154  0.00  0.00    +0.018 A 
ATOM     28  C   LIG    1        8.846  -1.363   0.529  0.00  0.00    +0.071 A 
ATOM     29  C   LIG    1        8.912  -0.362  -0.568  0.00  0.00    +0.250 A 
ATOM     30  O   LIG    1        9.974  -0.127  -1.132  0.00  0.00    -0.268 OA
ATOM     31  C   LIG    1        5.242  -1.115   1.296  0.00  0.00    +0.126 A 
ATOM     32  N   LIG    1        7.743   0.259  -0.900  0.00  0.00    -0.307 N 
ATOM     33  H   LIG    1        7.756   0.949  -1.637  0.00  0.00    +0.170 HD
ATOM     34  N   LIG    1        4.143  -0.447   0.890  0.00  0.00    -0.222 NA
ENDBRANCH  21  23
ENDBRANCH   4  21
TORSDOF 5