REMARK  Name = BDB015770
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.875  -1.075   0.439  0.00  0.00    +0.326 A 
ATOM      2  N   LIG    1       -1.317   0.187   0.354  0.00  0.00    -0.194 NA
ATOM      3  C   LIG    1       -0.377   1.147   0.372  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1        0.970   0.858   0.474  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        1.328  -0.475   0.534  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1        0.408  -1.449   0.532  0.00  0.00    -0.180 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -0.886   2.538   0.327  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1       -0.295   3.450  -0.469  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1       -0.747   4.760  -0.557  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1       -0.050   5.678  -1.444  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -1.852   5.217   0.159  0.00  0.00    +0.251 A 
ATOM     12  O   LIG    1       -2.299   6.360   0.116  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -2.518   4.212   1.026  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1       -2.051   2.959   1.089  0.00  0.00    +0.017 A 
ENDBRANCH   3   7
BRANCH   5  15
ATOM     15  N   LIG    1        2.684  -0.786   0.683  0.00  0.00    -0.323 N 
ATOM     16  H   LIG    1        3.269  -0.287   0.011  0.00  0.00    +0.148 HD
BRANCH  15  17
ATOM     17  C   LIG    1        3.010  -2.211   0.622  0.00  0.00    +0.158 C 
BRANCH  17  18
ATOM     18  C   LIG    1        4.509  -2.378   0.434  0.00  0.00    +0.058 A 
ATOM     19  N   LIG    1        5.136  -1.496  -0.398  0.00  0.00    -0.258 NA
ATOM     20  C   LIG    1        6.463  -1.665  -0.589  0.00  0.00    +0.111 A 
ATOM     21  C   LIG    1        7.205  -2.676  -0.003  0.00  0.00    +0.020 A 
ATOM     22  C   LIG    1        6.549  -3.575   0.830  0.00  0.00    +0.003 A 
ATOM     23  C   LIG    1        5.182  -3.430   1.051  0.00  0.00    +0.025 A 
ENDBRANCH  17  18
ENDBRANCH  15  17
ENDBRANCH   5  15
BRANCH   1  24
ATOM     24  O   LIG    1       -1.789  -2.125   0.454  0.00  0.00    -0.422 OA
BRANCH  24  27
ATOM     25  C   LIG    1       -2.530  -2.547  -2.262  0.00  0.00    +0.047 C 
ATOM     26  C   LIG    1       -3.490  -2.030  -1.228  0.00  0.00    -0.007 A 
ATOM     27  C   LIG    1       -3.081  -1.806   0.100  0.00  0.00    +0.152 A 
ATOM     28  C   LIG    1       -3.991  -1.338   1.061  0.00  0.00    +0.094 A 
ATOM     29  C   LIG    1       -5.306  -1.050   0.679  0.00  0.00    +0.022 A 
ATOM     30  C   LIG    1       -5.712  -1.238  -0.642  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1       -4.809  -1.725  -1.589  0.00  0.00    +0.007 A 
BRANCH  28  32
ATOM     32  C   LIG    1       -3.603  -1.144   2.427  0.00  0.00    +0.103 C 
ATOM     33  N   LIG    1       -3.314  -0.975   3.539  0.00  0.00    -0.191 NA
ENDBRANCH  28  32
ENDBRANCH  24  27
ENDBRANCH   1  24
TORSDOF 7