REMARK  Name = BDB026442
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.983  -1.914  -0.137  0.00  0.00    -0.280 N 
ATOM      2  C   LIG    1       -0.926  -1.045  -0.379  0.00  0.00    +0.305 C 
ATOM      3  O   LIG    1       -0.621  -0.545  -1.450  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1       -0.238  -0.874   0.820  0.00  0.00    -0.281 N 
ATOM      5  C   LIG    1       -0.726  -1.801   1.818  0.00  0.00    +0.128 C 
ATOM      6  C   LIG    1       -2.091  -2.210   1.276  0.00  0.00    +0.128 C 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1       -3.037  -2.184  -1.091  0.00  0.00    +0.146 C 
BRANCH   7  11
ATOM      8  C   LIG    1       -6.427   0.334  -0.496  0.00  0.00    +0.044 A 
ATOM      9  N   LIG    1       -5.295   0.854  -1.028  0.00  0.00    -0.259 NA
ATOM     10  C   LIG    1       -4.242   0.023  -1.203  0.00  0.00    +0.116 A 
ATOM     11  C   LIG    1       -4.251  -1.327  -0.874  0.00  0.00    -0.012 A 
ATOM     12  C   LIG    1       -5.426  -1.842  -0.323  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1       -6.525  -1.007  -0.133  0.00  0.00    +0.024 A 
BRANCH   8  15
ATOM     14  C   LIG    1       -7.252   2.391   0.673  0.00  0.00    +0.014 C 
ATOM     15  C   LIG    1       -7.605   1.268  -0.302  0.00  0.00    +0.032 C 
ATOM     16  C   LIG    1       -8.074   1.837  -1.642  0.00  0.00    +0.014 C 
ENDBRANCH   8  15
ENDBRANCH   7  11
ENDBRANCH   1   7
BRANCH   4  17
ATOM     17  C   LIG    1        1.058  -0.211   0.921  0.00  0.00    +0.142 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.187  -1.001   0.228  0.00  0.00    +0.146 C 
BRANCH  18  19
ATOM     19  O   LIG    1        2.165  -0.834  -1.197  0.00  0.00    -0.389 OA
ATOM     20  H   LIG    1        1.229  -0.715  -1.469  0.00  0.00    +0.210 HD
ENDBRANCH  18  19
BRANCH  18  21
ATOM     21  C   LIG    1        3.586  -0.628   0.778  0.00  0.00    +0.117 C 
BRANCH  21  22
ATOM     22  N   LIG    1        3.870   0.818   0.914  0.00  0.00    -0.295 NA
ATOM     23  C   LIG    1        5.153   1.046   1.611  0.00  0.00    +0.120 C 
ATOM     24  C   LIG    1        6.393   0.829   0.770  0.00  0.00    -0.030 A 
ATOM     25  C   LIG    1        6.336   0.899  -0.634  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        7.504   0.729  -1.388  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        8.727   0.514  -0.753  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        8.791   0.464   0.637  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.011   1.093  -1.332  0.00  0.00    +0.051 C 
ATOM     30  C   LIG    1        7.632   0.624   1.396  0.00  0.00    +0.005 A 
ATOM     31  C   LIG    1        3.900   1.543  -0.371  0.00  0.00    +0.089 C 
ENDBRANCH  21  22
ENDBRANCH  18  21
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 8