REMARK  Name = BDB060328
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.454  -0.758   2.268  0.00  0.00    +0.080 C 
ATOM      2  C   LIG    1        0.041   0.234   3.373  0.00  0.00    +0.028 C 
ATOM      3  C   LIG    1       -1.488   0.184   3.404  0.00  0.00    +0.039 C 
ATOM      4  C   LIG    1       -1.827  -0.231   2.001  0.00  0.00    -0.026 C 
ATOM      5  C   LIG    1       -0.756  -0.752   1.383  0.00  0.00    -0.003 C 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1       -3.157  -0.097   1.454  0.00  0.00    +0.046 A 
ATOM      7  N   LIG    1       -4.207  -0.421   2.271  0.00  0.00    -0.322 N 
ATOM      8  H   LIG    1       -4.036  -0.763   3.208  0.00  0.00    +0.169 HD
ATOM      9  C   LIG    1       -5.532  -0.376   1.905  0.00  0.00    +0.257 A 
ATOM     10  O   LIG    1       -6.423  -0.701   2.682  0.00  0.00    -0.267 OA
ATOM     11  C   LIG    1       -5.823   0.086   0.526  0.00  0.00    +0.048 A 
ATOM     12  C   LIG    1       -4.759   0.466  -0.314  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1       -5.048   0.947  -1.609  0.00  0.00    +0.033 A 
ATOM     14  C   LIG    1       -6.379   0.915  -2.060  0.00  0.00    +0.023 A 
ATOM     15  C   LIG    1       -7.424   0.528  -1.219  0.00  0.00    +0.003 A 
ATOM     16  C   LIG    1       -7.149   0.125   0.082  0.00  0.00    +0.014 A 
ATOM     17  C   LIG    1       -3.385   0.336   0.203  0.00  0.00    +0.036 A 
BRANCH  13  18
ATOM     18  N   LIG    1       -4.042   1.265  -2.542  0.00  0.00    -0.357 N 
ATOM     19  H   LIG    1       -3.208   1.664  -2.126  0.00  0.00    +0.142 HD
ATOM     20  H   LIG    1       -4.373   1.833  -3.317  0.00  0.00    +0.142 HD
ENDBRANCH  13  18
ENDBRANCH   4   6
BRANCH   1  24
ATOM     21  N   LIG    1        3.128  -0.043  -0.997  0.00  0.00    -0.327 N 
ATOM     22  C   LIG    1        3.102   0.982   0.076  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        1.845   0.847   0.971  0.00  0.00    +0.104 C 
ATOM     24  N   LIG    1        1.741  -0.468   1.637  0.00  0.00    -0.293 NA
ATOM     25  C   LIG    1        2.218  -1.565   0.763  0.00  0.00    +0.104 C 
ATOM     26  C   LIG    1        2.276  -1.220  -0.741  0.00  0.00    +0.120 C 
BRANCH  21  30
ATOM     27  C   LIG    1        6.944  -0.402  -2.802  0.00  0.00    +0.052 A 
ATOM     28  C   LIG    1        6.241   0.801  -2.842  0.00  0.00    +0.020 A 
ATOM     29  C   LIG    1        4.982   0.896  -2.238  0.00  0.00    +0.024 A 
ATOM     30  C   LIG    1        4.390  -0.198  -1.583  0.00  0.00    +0.030 A 
ATOM     31  C   LIG    1        5.115  -1.397  -1.556  0.00  0.00    +0.024 A 
ATOM     32  C   LIG    1        6.378  -1.502  -2.156  0.00  0.00    +0.020 A 
BRANCH  27  34
ATOM     33  N   LIG    1        9.279  -0.595  -3.913  0.00  0.00    -0.191 NA
ATOM     34  C   LIG    1        8.234  -0.508  -3.417  0.00  0.00    +0.099 C 
ENDBRANCH  27  34
ENDBRANCH  21  30
ENDBRANCH   1  24
TORSDOF 5