REMARK  Name = BDB034153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.000   2.051  -0.483  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1        0.066   3.015  -0.173  0.00  0.00    +0.089 C 
ATOM      3  C   LIG    1        1.321   2.302   0.364  0.00  0.00    +0.051 C 
ATOM      4  C   LIG    1        1.687   1.083  -0.447  0.00  0.00    -0.040 C 
ATOM      5  C   LIG    1        0.816   0.582  -1.342  0.00  0.00    -0.007 C 
ATOM      6  C   LIG    1       -0.563   1.144  -1.560  0.00  0.00    +0.112 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.014   0.472  -0.256  0.00  0.00    -0.004 A 
ATOM      8  C   LIG    1        3.160  -0.899  -0.038  0.00  0.00    +0.119 A 
ATOM      9  N   LIG    1        4.343  -1.530   0.150  0.00  0.00    -0.250 NA
ATOM     10  C   LIG    1        5.454  -0.756   0.120  0.00  0.00    +0.125 A 
ATOM     11  C   LIG    1        5.424   0.620  -0.086  0.00  0.00    +0.033 A 
ATOM     12  C   LIG    1        4.185   1.235  -0.273  0.00  0.00    +0.012 A 
BRANCH  10  13
ATOM     13  C   LIG    1        6.761  -1.454   0.324  0.00  0.00    +0.263 C 
ATOM     14  N   LIG    1        7.614  -0.846   1.235  0.00  0.00    -0.307 N 
ATOM     15  H   LIG    1        7.245  -0.114   1.830  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1        7.029  -2.487  -0.281  0.00  0.00    -0.269 OA
BRANCH  14  17
ATOM     17  C   LIG    1        8.876  -1.420   1.581  0.00  0.00    +0.073 C 
ATOM     18  C   LIG    1       10.138  -0.924   0.933  0.00  0.00    +0.024 C 
ATOM     19  C   LIG    1        9.879  -0.637   2.383  0.00  0.00    +0.024 C 
ENDBRANCH  14  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1       -2.244   2.752  -0.843  0.00  0.00    +0.121 C 
BRANCH  20  30
ATOM     21  C   LIG    1       -7.220  -1.409  -0.225  0.00  0.00    +0.019 A 
ATOM     22  C   LIG    1       -6.368  -1.510   1.007  0.00  0.00    +0.252 A 
ATOM     23  O   LIG    1       -6.641  -2.279   1.923  0.00  0.00    -0.268 OA
ATOM     24  N   LIG    1       -5.262  -0.702   1.068  0.00  0.00    -0.321 N 
ATOM     25  H   LIG    1       -4.697  -0.781   1.903  0.00  0.00    +0.169 HD
ATOM     26  C   LIG    1       -4.901   0.182   0.045  0.00  0.00    +0.068 A 
ATOM     27  C   LIG    1       -5.681   0.270  -1.105  0.00  0.00    +0.088 A 
ATOM     28  N   LIG    1       -5.407   1.094  -2.138  0.00  0.00    -0.253 NA
ATOM     29  C   LIG    1       -4.298   1.861  -2.012  0.00  0.00    +0.116 A 
ATOM     30  C   LIG    1       -3.446   1.843  -0.908  0.00  0.00    -0.013 A 
ATOM     31  C   LIG    1       -3.771   0.982   0.149  0.00  0.00    +0.034 A 
ATOM     32  C   LIG    1       -6.869  -0.570  -1.216  0.00  0.00    +0.038 A 
BRANCH  21  34
ATOM     33  C   LIG    1       -9.589  -1.776   0.528  0.00  0.00    +0.009 C 
ATOM     34  C   LIG    1       -8.427  -2.303  -0.302  0.00  0.00    +0.037 C 
ENDBRANCH  21  34
ENDBRANCH  20  30
ENDBRANCH   1  20
TORSDOF 6