REMARK  Name = BDB032418
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.123  -2.151  -1.043  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1       -1.141  -0.472  -0.102  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1       -0.890   0.079   1.102  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1        0.350  -0.099   1.603  0.00  0.00    +0.115 A 
ATOM      5  C   LIG    1        1.349  -0.812   0.959  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1        1.068  -1.387  -0.283  0.00  0.00    -0.024 A 
ATOM      7  C   LIG    1       -0.209  -1.202  -0.823  0.00  0.00    +0.072 A 
BRANCH   2   8
ATOM      8  O   LIG    1       -2.384  -0.338  -0.687  0.00  0.00    -0.476 OA
BRANCH   8   9
ATOM      9  C   LIG    1       -3.318   0.462   0.048  0.00  0.00    +0.234 C 
BRANCH   9  14
ATOM     10  C   LIG    1       -7.985   0.119  -0.525  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1       -6.614   0.069  -0.028  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1       -5.949  -1.178  -0.439  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1       -4.786  -1.584   0.477  0.00  0.00    +0.022 C 
ATOM     14  C   LIG    1       -4.079  -0.373   1.099  0.00  0.00    +0.029 C 
ATOM     15  C   LIG    1       -5.099   0.498   1.859  0.00  0.00    +0.022 C 
ATOM     16  C   LIG    1       -6.551   0.271   1.417  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   8   9
ENDBRANCH   2   8
ENDBRANCH   1   6
BRANCH   1  17
ATOM     17  N   LIG    1        2.955  -1.234  -1.818  0.00  0.00    -0.340 N 
ATOM     18  H   LIG    1        2.379  -0.559  -2.316  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.074  -0.632  -1.236  0.00  0.00    +0.028 A 
ATOM     20  C   LIG    1        4.436   0.662  -1.638  0.00  0.00    +0.031 A 
ATOM     21  C   LIG    1        5.575   1.316  -1.128  0.00  0.00    -0.011 A 
ATOM     22  C   LIG    1        6.410   0.655  -0.207  0.00  0.00    +0.022 A 
ATOM     23  C   LIG    1        7.542   1.360   0.273  0.00  0.00    +0.124 A 
ATOM     24  N   LIG    1        7.843   2.615  -0.109  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1        7.023   3.213  -0.993  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1        6.067  -0.665   0.163  0.00  0.00    +0.014 A 
ATOM     27  C   LIG    1        5.896   2.617  -1.525  0.00  0.00    +0.028 A 
ATOM     28  C   LIG    1        4.928  -1.295  -0.354  0.00  0.00    +0.023 A 
BRANCH  23  29
ATOM     29  N   LIG    1        8.432   0.774   1.189  0.00  0.00    -0.343 N 
ATOM     30  H   LIG    1        7.924   0.514   2.028  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1        8.829  -0.063   0.774  0.00  0.00    +0.144 HD
ENDBRANCH  23  29
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7