REMARK  Name = BDB015955
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.371   0.235   0.215  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.745  -0.509   0.352  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.943   0.109   0.270  0.00  0.00    +0.132 A 
ATOM      4  C   LIG    1       -2.043   1.475   0.013  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -0.838   2.145  -0.096  0.00  0.00    +0.126 A 
ATOM      6  N   LIG    1        0.373   1.560   0.001  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.140  -0.390   0.231  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.890   0.246   0.141  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.676  -0.452   0.316  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        1.763  -1.830   0.590  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        2.996  -2.478   0.685  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.177  -1.761   0.507  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        8.808   0.895  -0.882  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        7.431   0.923  -0.453  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        6.895   2.081  -0.031  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        5.636   1.748   0.269  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.362   0.376   0.050  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.558  -0.125  -0.424  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.295   2.205  -0.154  0.00  0.00    +0.097 A 
ATOM     20  N   LIG    1       -3.416   3.481   0.256  0.00  0.00    -0.171 NA
ATOM     21  N   LIG    1       -4.675   3.824  -0.065  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.147   5.153   0.242  0.00  0.00    +0.172 C 
ATOM     23  C   LIG    1       -5.372   2.828  -0.675  0.00  0.00    +0.108 A 
ATOM     24  C   LIG    1       -4.506   1.764  -0.755  0.00  0.00    +0.049 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -3.106  -0.673   0.438  0.00  0.00    -0.324 N 
ATOM     26  H   LIG    1       -3.695  -0.223   1.135  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -2.895  -2.091   0.737  0.00  0.00    +0.087 C 
ATOM     28  C   LIG    1       -2.434  -2.917  -0.481  0.00  0.00    +0.103 C 
ATOM     29  N   LIG    1       -3.375  -4.042  -0.621  0.00  0.00    -0.314 NA
ATOM     30  H   LIG    1       -2.884  -4.893  -0.888  0.00  0.00    +0.122 HD
ATOM     31  C   LIG    1       -4.030  -4.184   0.674  0.00  0.00    +0.083 C 
ATOM     32  C   LIG    1       -4.218  -2.749   1.121  0.00  0.00    +0.038 C 
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 5