REMARK  Name = BDB019819
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.741   0.592  -0.044  0.00  0.00    +0.222 A 
ATOM      2  N   LIG    1       -2.921  -0.049  -0.154  0.00  0.00    -0.199 NA
ATOM      3  C   LIG    1       -4.043   0.543   0.304  0.00  0.00    +0.138 A 
ATOM      4  N   LIG    1       -5.253  -0.135   0.196  0.00  0.00    -0.301 N 
ATOM      5  C   LIG    1       -6.380   0.327   1.036  0.00  0.00    +0.168 C 
ATOM      6  C   LIG    1       -6.515   1.841   0.976  0.00  0.00    +0.111 C 
ATOM      7  C   LIG    1       -5.200   2.489   1.303  0.00  0.00    +0.170 C 
ATOM      8  O   LIG    1       -5.122   3.574   1.871  0.00  0.00    -0.292 OA
ATOM      9  C   LIG    1       -7.719  -0.322   0.609  0.00  0.00    +0.234 C 
ATOM     10  O   LIG    1       -8.807   0.244   0.666  0.00  0.00    -0.274 OA
ATOM     11  N   LIG    1       -7.646  -1.634   0.208  0.00  0.00    -0.312 N 
ATOM     12  H   LIG    1       -8.523  -2.099   0.010  0.00  0.00    +0.149 HD
ATOM     13  C   LIG    1       -6.396  -2.354   0.280  0.00  0.00    +0.123 C 
ATOM     14  C   LIG    1       -5.224  -1.530  -0.274  0.00  0.00    +0.126 C 
ATOM     15  C   LIG    1       -3.984   1.806   0.854  0.00  0.00    +0.076 A 
ATOM     16  C   LIG    1       -2.750   2.400   0.941  0.00  0.00    +0.129 A 
ATOM     17  N   LIG    1       -1.621   1.809   0.504  0.00  0.00    -0.222 NA
ENDROOT
BRANCH   1  18
ATOM     18  N   LIG    1       -0.647  -0.096  -0.533  0.00  0.00    -0.268 N 
ATOM     19  H   LIG    1       -0.893  -0.996  -0.911  0.00  0.00    +0.156 HD
BRANCH  18  23
ATOM     20  C   LIG    1        3.498   0.473  -0.877  0.00  0.00    +0.048 A 
ATOM     21  C   LIG    1        2.780  -0.645  -1.300  0.00  0.00    +0.136 A 
ATOM     22  N   LIG    1        1.436  -0.826  -1.180  0.00  0.00    -0.238 NA
ATOM     23  C   LIG    1        0.708   0.161  -0.621  0.00  0.00    +0.125 A 
ATOM     24  C   LIG    1        1.318   1.327  -0.188  0.00  0.00    +0.045 A 
ATOM     25  C   LIG    1        2.703   1.479  -0.323  0.00  0.00    +0.028 A 
BRANCH  20  30
ATOM     26  C   LIG    1        8.278  -0.582  -0.111  0.00  0.00    +0.105 C 
ATOM     27  N   LIG    1        6.950  -1.110   0.196  0.00  0.00    -0.302 NA
ATOM     28  C   LIG    1        6.147  -0.143   0.981  0.00  0.00    +0.103 C 
ATOM     29  C   LIG    1        5.618   1.079   0.188  0.00  0.00    +0.120 C 
ATOM     30  N   LIG    1        4.875   0.648  -1.020  0.00  0.00    -0.326 N 
ATOM     31  C   LIG    1        5.662  -0.283  -1.857  0.00  0.00    +0.120 C 
ATOM     32  C   LIG    1        6.210  -1.475  -1.034  0.00  0.00    +0.103 C 
ENDBRANCH  20  30
ENDBRANCH  18  23
ENDBRANCH   1  18
TORSDOF 3