REMARK  Name = BDB026670
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.553  -1.674   0.027  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.376  -2.423  -0.066  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.153  -1.742  -0.159  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        0.895  -2.267  -0.205  0.00  0.00    -0.227 NA
ATOM      5  C   LIG    1        0.069  -1.243  -0.320  0.00  0.00    +0.147 A 
ATOM      6  N   LIG    1        0.768  -0.031  -0.287  0.00  0.00    -0.292 N 
ATOM      7  C   LIG    1        2.123  -0.351  -0.203  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        3.300   0.411  -0.098  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        4.515  -0.277  -0.002  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1        0.216   1.284  -0.308  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -0.949   1.569   0.419  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -1.507   2.854   0.381  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -2.698   3.209   1.228  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -3.516   4.319   0.589  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -2.651   5.467   0.124  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -1.429   5.138  -0.400  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -0.917   5.901  -0.826  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -3.047   6.630   0.120  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -0.885   3.852  -0.374  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1        0.285   3.582  -1.080  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1        0.833   2.296  -1.054  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   5  22
ATOM     22  C   LIG    1       -1.372  -1.416  -0.528  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1       -2.098  -2.230   0.342  0.00  0.00    +0.078 A 
ATOM     24  C   LIG    1       -3.457  -2.379   0.127  0.00  0.00    +0.215 A 
ATOM     25  N   LIG    1       -4.126  -1.785  -0.883  0.00  0.00    -0.221 NA
ATOM     26  C   LIG    1       -3.398  -1.030  -1.732  0.00  0.00    +0.115 A 
ATOM     27  C   LIG    1       -2.036  -0.821  -1.603  0.00  0.00    +0.031 A 
BRANCH  24  28
ATOM     28  O   LIG    1       -4.134  -3.175   1.030  0.00  0.00    -0.480 OA
ATOM     29  C   LIG    1       -5.514  -3.327   0.715  0.00  0.00    +0.279 C 
ENDBRANCH  24  28
ENDBRANCH   5  22
BRANCH   1  33
ATOM     30  C   LIG    1        5.250  -3.748   2.115  0.00  0.00    +0.128 C 
ATOM     31  N   LIG    1        6.076  -3.367   0.992  0.00  0.00    -0.314 N 
ATOM     32  H   LIG    1        7.018  -3.738   0.952  0.00  0.00    +0.149 HD
ATOM     33  C   LIG    1        5.874  -2.337   0.109  0.00  0.00    +0.244 C 
ATOM     34  O   LIG    1        6.791  -1.947  -0.609  0.00  0.00    -0.270 OA
ENDBRANCH   1  33
TORSDOF 4