REMARK  Name = BDB013746
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.742  -1.928   1.263  0.00  0.00    +0.106 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.551  -1.344   0.684  0.00  0.00    -0.028 A 
ATOM      3  C   LIG    1        0.578  -0.143  -0.040  0.00  0.00    +0.009 A 
ATOM      4  C   LIG    1        1.777   0.351  -0.561  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        2.976  -0.338  -0.377  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        2.965  -1.534   0.338  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1        1.765  -2.030   0.861  0.00  0.00    +0.009 A 
BRANCH   5   8
ATOM      8  O   LIG    1        4.069   0.257  -0.941  0.00  0.00    -0.487 OA
BRANCH   8   9
ATOM      9  C   LIG    1        5.328  -0.390  -0.763  0.00  0.00    +0.264 C 
BRANCH   9  10
ATOM     10  C   LIG    1        6.410   0.445  -1.406  0.00  0.00    -0.010 A 
ATOM     11  C   LIG    1        6.544   1.805  -1.087  0.00  0.00    +0.007 A 
ATOM     12  C   LIG    1        7.559   2.573  -1.659  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        8.455   1.990  -2.552  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1        8.337   0.639  -2.873  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        7.322  -0.131  -2.302  0.00  0.00    +0.007 A 
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   5   8
ENDBRANCH   1   2
BRANCH   1  16
ATOM     16  N   LIG    1       -1.430  -2.946   0.403  0.00  0.00    -0.300 NA
ATOM     17  C   LIG    1       -1.030  -4.310   0.754  0.00  0.00    +0.105 C 
ATOM     18  C   LIG    1       -1.268  -2.742  -1.039  0.00  0.00    +0.105 C 
ENDBRANCH   1  16
BRANCH   1  20
ATOM     19  C   LIG    1       -2.629  -1.437   2.923  0.00  0.00    +0.030 C 
ATOM     20  C   LIG    1       -1.763  -0.845   1.801  0.00  0.00    +0.090 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -2.656  -0.392   0.727  0.00  0.00    -0.323 N 
ATOM     22  H   LIG    1       -3.078  -1.189   0.261  0.00  0.00    +0.148 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -3.350   0.800   0.765  0.00  0.00    +0.147 A 
ATOM     24  C   LIG    1       -4.409   1.058  -0.249  0.00  0.00    +0.029 A 
ATOM     25  C   LIG    1       -5.147   2.229  -0.132  0.00  0.00    +0.051 A 
ATOM     26  C   LIG    1       -6.170   2.517  -1.048  0.00  0.00    +0.014 A 
ATOM     27  C   LIG    1       -6.444   1.633  -2.090  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -5.694   0.467  -2.223  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1       -4.836   3.180   0.947  0.00  0.00    +0.275 A 
ATOM     30  O   LIG    1       -5.518   4.195   1.072  0.00  0.00    -0.266 OA
ATOM     31  N   LIG    1       -3.757   2.856   1.758  0.00  0.00    -0.230 N 
ATOM     32  C   LIG    1       -3.386   3.732   2.852  0.00  0.00    +0.176 C 
ATOM     33  C   LIG    1       -4.676   0.178  -1.308  0.00  0.00    +0.012 A 
ATOM     34  N   LIG    1       -3.063   1.678   1.685  0.00  0.00    -0.153 NA
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 8