REMARK  Name = BDB051736
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.214   1.339  -0.038  0.00  0.00    +0.216 A 
ATOM      2  N   LIG    1        2.989   0.343   0.404  0.00  0.00    -0.213 NA
ATOM      3  C   LIG    1        4.312   0.550   0.336  0.00  0.00    +0.097 A 
ATOM      4  C   LIG    1        5.193  -0.490   0.833  0.00  0.00    +0.091 A 
ATOM      5  N   LIG    1        4.912  -1.753   1.261  0.00  0.00    -0.264 N 
ATOM      6  C   LIG    1        3.624  -2.403   1.327  0.00  0.00    +0.173 C 
ATOM      7  N   LIG    1        6.009  -2.430   1.658  0.00  0.00    -0.166 NA
ATOM      8  C   LIG    1        7.030  -1.562   1.522  0.00  0.00    +0.151 A 
ATOM      9  C   LIG    1        6.557  -0.327   0.998  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1        7.213   0.987   0.731  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1        6.403   1.834  -0.285  0.00  0.00    +0.043 C 
ATOM     12  C   LIG    1        4.906   1.700  -0.161  0.00  0.00    -0.001 A 
ATOM     13  C   LIG    1        4.019   2.644  -0.610  0.00  0.00    +0.120 A 
ATOM     14  N   LIG    1        2.683   2.487  -0.555  0.00  0.00    -0.223 NA
ENDROOT
BRANCH   8  15
ATOM     15  C   LIG    1        8.401  -1.942   1.899  0.00  0.00    +0.262 C 
ATOM     16  O   LIG    1        8.695  -2.672   2.841  0.00  0.00    -0.269 OA
ATOM     17  N   LIG    1        9.393  -1.458   1.083  0.00  0.00    -0.324 N 
ATOM     18  H   LIG    1       10.293  -1.892   1.239  0.00  0.00    +0.145 HD
ATOM     19  H   LIG    1        9.159  -1.222   0.129  0.00  0.00    +0.145 HD
ENDBRANCH   8  15
BRANCH   1  20
ATOM     20  N   LIG    1        0.850   1.124   0.060  0.00  0.00    -0.309 N 
ATOM     21  H   LIG    1        0.707   0.128   0.171  0.00  0.00    +0.149 HD
BRANCH  20  22
ATOM     22  C   LIG    1        0.068   1.740  -0.991  0.00  0.00    +0.139 C 
BRANCH  22  26
ATOM     23  C   LIG    1       -4.044   0.284  -0.705  0.00  0.00    +0.030 A 
ATOM     24  C   LIG    1       -3.501   1.169   0.240  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1       -2.185   1.641   0.149  0.00  0.00    +0.007 A 
ATOM     26  C   LIG    1       -1.356   1.242  -0.902  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -1.872   0.357  -1.851  0.00  0.00    +0.007 A 
ATOM     28  C   LIG    1       -3.192  -0.105  -1.750  0.00  0.00    +0.023 A 
BRANCH  23  33
ATOM     29  C   LIG    1       -9.382  -0.662   0.013  0.00  0.00    +0.105 C 
ATOM     30  N   LIG    1       -8.125  -1.289  -0.387  0.00  0.00    -0.302 NA
ATOM     31  C   LIG    1       -7.139  -1.296   0.714  0.00  0.00    +0.103 C 
ATOM     32  C   LIG    1       -6.072  -0.176   0.672  0.00  0.00    +0.120 C 
ATOM     33  N   LIG    1       -5.347  -0.175  -0.610  0.00  0.00    -0.327 N 
ATOM     34  C   LIG    1       -6.047  -0.777  -1.757  0.00  0.00    +0.120 C 
ATOM     35  C   LIG    1       -7.578  -0.631  -1.594  0.00  0.00    +0.103 C 
ENDBRANCH  23  33
ENDBRANCH  22  26
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 5