REMARK  Name = BDB034175
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.466   1.054  -0.952  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1        0.018  -0.335  -0.870  0.00  0.00    +0.089 C 
ATOM      3  C   LIG    1        1.313  -0.416  -0.041  0.00  0.00    +0.051 C 
ATOM      4  C   LIG    1        2.301   0.650  -0.429  0.00  0.00    -0.040 C 
ATOM      5  C   LIG    1        1.927   1.703  -1.177  0.00  0.00    -0.007 C 
ATOM      6  C   LIG    1        0.515   1.899  -1.655  0.00  0.00    +0.112 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.683   0.509   0.048  0.00  0.00    -0.001 A 
ATOM      8  C   LIG    1        4.733   0.042  -0.758  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1        4.508  -0.364  -2.187  0.00  0.00    +0.066 C 
ATOM     10  N   LIG    1        6.010  -0.077  -0.307  0.00  0.00    -0.247 NA
ATOM     11  C   LIG    1        6.249   0.280   0.988  0.00  0.00    +0.126 A 
ATOM     12  C   LIG    1        5.273   0.747   1.854  0.00  0.00    +0.033 A 
ATOM     13  C   LIG    1        3.973   0.862   1.372  0.00  0.00    +0.012 A 
BRANCH  11  14
ATOM     14  C   LIG    1        7.665   0.138   1.463  0.00  0.00    +0.262 C 
ATOM     15  N   LIG    1        8.543  -0.301   0.495  0.00  0.00    -0.313 N 
ATOM     16  H   LIG    1        8.126  -0.568  -0.393  0.00  0.00    +0.149 HD
ATOM     17  C   LIG    1        9.913  -0.625   0.786  0.00  0.00    +0.128 C 
ATOM     18  O   LIG    1        7.982   0.388   2.620  0.00  0.00    -0.269 OA
ENDBRANCH  11  14
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -1.777   1.152  -1.607  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.994  -1.454   1.102  0.00  0.00    +0.260 C 
ATOM     21  C   LIG    1       -6.729  -2.263  -0.179  0.00  0.00    +0.258 C 
ATOM     22  O   LIG    1       -7.450  -3.180  -0.563  0.00  0.00    -0.271 OA
ATOM     23  N   LIG    1       -5.667  -1.839  -0.929  0.00  0.00    -0.278 N 
ATOM     24  H   LIG    1       -5.514  -2.300  -1.816  0.00  0.00    +0.155 HD
ATOM     25  C   LIG    1       -4.805  -0.847  -0.461  0.00  0.00    +0.096 A 
ATOM     26  C   LIG    1       -4.947  -0.321   0.822  0.00  0.00    +0.237 A 
ATOM     27  N   LIG    1       -4.128   0.621   1.327  0.00  0.00    -0.219 NA
ATOM     28  C   LIG    1       -3.130   1.058   0.524  0.00  0.00    +0.119 A 
ATOM     29  C   LIG    1       -2.902   0.594  -0.771  0.00  0.00    -0.013 A 
ATOM     30  C   LIG    1       -3.769  -0.385  -1.267  0.00  0.00    +0.035 A 
ATOM     31  O   LIG    1       -5.902  -0.761   1.697  0.00  0.00    -0.462 OA
BRANCH  20  33
ATOM     32  C   LIG    1       -8.630   0.215   2.109  0.00  0.00    +0.008 C 
ATOM     33  C   LIG    1       -8.144  -0.468   0.838  0.00  0.00    +0.051 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 5