REMARK  Name = BDB059703
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.930  -0.488  -1.138  0.00  0.00    +0.023 A 
ATOM      2  C   LIG    1        1.069   0.434  -1.754  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1       -0.184   0.032  -2.230  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.591  -1.295  -2.079  0.00  0.00    +0.128 A 
ATOM      5  C   LIG    1        0.262  -2.226  -1.490  0.00  0.00    +0.047 A 
ATOM      6  C   LIG    1        1.514  -1.822  -1.015  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        5.140  -0.206   0.258  0.00  0.00    +0.248 A 
ATOM      8  O   LIG    1        4.978   1.091  -0.137  0.00  0.00    -0.336 OA
ATOM      9  N   LIG    1        3.722   1.173  -0.728  0.00  0.00    -0.056 NA
ATOM     10  C   LIG    1        3.240  -0.078  -0.639  0.00  0.00    +0.202 A 
ATOM     11  N   LIG    1        4.103  -0.962  -0.024  0.00  0.00    -0.190 NA
BRANCH   7  12
ATOM     12  C   LIG    1        6.427  -0.562   0.931  0.00  0.00    +0.161 C 
BRANCH  12  13
ATOM     13  N   LIG    1        7.542   0.129   0.289  0.00  0.00    -0.304 N 
ATOM     14  H   LIG    1        7.376   1.049  -0.101  0.00  0.00    +0.149 HD
ATOM     15  C   LIG    1        8.829  -0.338   0.390  0.00  0.00    +0.211 C 
ATOM     16  O   LIG    1        9.128  -1.371   0.979  0.00  0.00    -0.276 OA
ATOM     17  C   LIG    1        9.861   0.531  -0.277  0.00  0.00    +0.109 C 
ENDBRANCH  12  13
BRANCH  12  19
ATOM     18  C   LIG    1        6.255   1.157   2.851  0.00  0.00    +0.006 C 
ATOM     19  C   LIG    1        6.373  -0.309   2.449  0.00  0.00    +0.028 C 
ENDBRANCH  12  19
ENDBRANCH   7  12
ENDBRANCH   1  10
BRANCH   4  20
ATOM     20  O   LIG    1       -1.793  -1.763  -2.558  0.00  0.00    -0.456 OA
BRANCH  20  21
ATOM     21  C   LIG    1       -2.916  -1.024  -2.266  0.00  0.00    +0.129 A 
ATOM     22  C   LIG    1       -3.804  -0.774  -3.309  0.00  0.00    +0.050 A 
ATOM     23  C   LIG    1       -4.977  -0.059  -3.063  0.00  0.00    +0.049 A 
ATOM     24  C   LIG    1       -5.276   0.402  -1.777  0.00  0.00    +0.121 A 
ATOM     25  C   LIG    1       -4.398   0.119  -0.729  0.00  0.00    +0.049 A 
ATOM     26  C   LIG    1       -3.221  -0.597  -0.972  0.00  0.00    +0.050 A 
BRANCH  24  27
ATOM     27  O   LIG    1       -6.460   1.079  -1.676  0.00  0.00    -0.487 OA
BRANCH  27  28
ATOM     28  C   LIG    1       -6.723   1.813  -0.476  0.00  0.00    +0.264 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -7.359   0.981   0.615  0.00  0.00    -0.010 A 
ATOM     30  C   LIG    1       -8.188  -0.109   0.314  0.00  0.00    +0.007 A 
ATOM     31  C   LIG    1       -8.787  -0.849   1.335  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -8.575  -0.501   2.667  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -7.767   0.590   2.980  0.00  0.00    +0.000 A 
ATOM     34  C   LIG    1       -7.166   1.331   1.960  0.00  0.00    +0.007 A 
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  24  27
ENDBRANCH  20  21
ENDBRANCH   4  20
TORSDOF 9