REMARK  Name = BDB015986
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.492   0.015   0.396  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.628  -0.549   0.887  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.825  -0.057   0.495  0.00  0.00    +0.133 A 
ATOM      4  C   LIG    1       -1.916   1.020  -0.393  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.704   1.524  -0.830  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.502   1.046  -0.464  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   3   7
ATOM      7  N   LIG    1       -2.992  -0.698   0.982  0.00  0.00    -0.312 N 
ATOM      8  C   LIG    1       -2.821  -1.304   2.323  0.00  0.00    +0.121 C 
ATOM      9  C   LIG    1       -2.608  -2.831   2.254  0.00  0.00    +0.100 C 
ATOM     10  N   LIG    1       -3.707  -3.572   1.601  0.00  0.00    -0.313 NA
ATOM     11  H   LIG    1       -4.391  -3.856   2.302  0.00  0.00    +0.122 HD
ATOM     12  C   LIG    1       -4.394  -2.731   0.599  0.00  0.00    +0.100 C 
ATOM     13  C   LIG    1       -3.497  -1.651  -0.044  0.00  0.00    +0.121 C 
ENDBRANCH   3   7
BRANCH   1  16
ATOM     14  C   LIG    1        4.255  -0.467   0.843  0.00  0.00    -0.014 A 
ATOM     15  C   LIG    1        3.011   0.050   0.441  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        1.790  -0.542   0.829  0.00  0.00    +0.020 A 
ATOM     17  C   LIG    1        1.863  -1.686   1.645  0.00  0.00    +0.011 A 
ATOM     18  C   LIG    1        3.089  -2.212   2.056  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        4.278  -1.604   1.657  0.00  0.00    +0.008 A 
BRANCH  14  24
ATOM     20  C   LIG    1        7.662   2.063  -1.740  0.00  0.00    +0.172 C 
ATOM     21  N   LIG    1        6.993   1.282  -0.728  0.00  0.00    -0.274 N 
ATOM     22  N   LIG    1        7.680   0.869   0.351  0.00  0.00    -0.179 NA
ATOM     23  C   LIG    1        6.771   0.189   1.055  0.00  0.00    +0.142 A 
ATOM     24  C   LIG    1        5.500   0.163   0.434  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        5.687   0.884  -0.728  0.00  0.00    +0.116 A 
ENDBRANCH  14  24
ENDBRANCH   1  16
BRANCH   4  26
ATOM     26  C   LIG    1       -3.166   1.633  -0.811  0.00  0.00    +0.024 A 
ATOM     27  C   LIG    1       -3.411   2.174  -2.059  0.00  0.00    +0.116 A 
ATOM     28  N   LIG    1       -4.696   2.636  -2.030  0.00  0.00    -0.274 N 
ATOM     29  C   LIG    1       -5.411   3.283  -3.102  0.00  0.00    +0.172 C 
ATOM     30  N   LIG    1       -5.311   2.436  -0.852  0.00  0.00    -0.179 NA
ATOM     31  C   LIG    1       -4.379   1.828  -0.112  0.00  0.00    +0.143 A 
ENDBRANCH   4  26
TORSDOF 4