REMARK  Name = BDB026417
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.638  -1.099   1.811  0.00  0.00    -0.279 N 
ATOM      2  C   LIG    1       -1.315  -1.220   2.231  0.00  0.00    +0.306 C 
ATOM      3  O   LIG    1       -0.733  -0.480   3.006  0.00  0.00    -0.252 OA
ATOM      4  N   LIG    1       -0.780  -2.317   1.566  0.00  0.00    -0.276 N 
ATOM      5  C   LIG    1       -1.803  -3.004   0.753  0.00  0.00    +0.055 C 
ATOM      6  C   LIG    1       -1.390  -3.624  -0.605  0.00  0.00    +0.027 C 
ATOM      7  C   LIG    1       -2.313  -4.814  -0.266  0.00  0.00    +0.004 C 
ATOM      8  C   LIG    1       -2.140  -4.446   1.222  0.00  0.00    +0.027 C 
ATOM      9  C   LIG    1       -2.972  -2.006   0.727  0.00  0.00    +0.135 C 
ENDROOT
BRANCH   1  10
ATOM     10  C   LIG    1       -3.422   0.088   2.095  0.00  0.00    +0.146 C 
BRANCH  10  15
ATOM     11  C   LIG    1       -2.249   4.262  -1.697  0.00  0.00    +0.065 C 
ATOM     12  C   LIG    1       -2.597   3.180  -0.721  0.00  0.00    +0.038 A 
ATOM     13  N   LIG    1       -1.774   3.013   0.339  0.00  0.00    -0.260 NA
ATOM     14  C   LIG    1       -2.081   2.031   1.219  0.00  0.00    +0.116 A 
ATOM     15  C   LIG    1       -3.180   1.188   1.098  0.00  0.00    -0.012 A 
ATOM     16  C   LIG    1       -4.015   1.382  -0.004  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1       -3.723   2.388  -0.923  0.00  0.00    +0.023 A 
ENDBRANCH  10  15
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  C   LIG    1        0.614  -2.684   1.694  0.00  0.00    +0.142 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.603  -1.628   1.152  0.00  0.00    +0.146 C 
BRANCH  19  20
ATOM     20  O   LIG    1        2.940  -2.114   1.373  0.00  0.00    -0.389 OA
ATOM     21  H   LIG    1        3.111  -2.828   0.736  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        1.386  -1.335  -0.356  0.00  0.00    +0.117 C 
BRANCH  22  23
ATOM     23  N   LIG    1        1.946  -0.092  -0.916  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        3.380   0.086  -0.644  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        3.933   1.367  -1.238  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        3.086   2.459  -1.502  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        3.623   3.650  -2.008  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        4.995   3.765  -2.229  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        5.839   2.692  -1.951  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        1.596   2.326  -1.300  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        5.313   1.500  -1.454  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        1.210   1.100  -0.461  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   4  18
TORSDOF 7