REMARK  Name = BDB005577
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.035   0.109   0.362  0.00  0.00    +0.031 A 
ATOM      2  C   LIG    1       -1.234  -0.452  -0.648  0.00  0.00    +0.049 A 
ATOM      3  C   LIG    1        0.166  -0.473  -0.560  0.00  0.00    +0.053 A 
ATOM      4  N   LIG    1        0.908  -1.043  -1.607  0.00  0.00    -0.321 N 
ATOM      5  H   LIG    1        0.434  -1.435  -2.411  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1        2.281  -1.119  -1.627  0.00  0.00    +0.258 A 
ATOM      7  C   LIG    1        3.011  -0.562  -0.469  0.00  0.00    +0.065 A 
ATOM      8  C   LIG    1        2.300   0.009   0.583  0.00  0.00    +0.085 A 
ATOM      9  N   LIG    1        2.921   0.538   1.673  0.00  0.00    -0.254 NA
ATOM     10  C   LIG    1        4.273   0.490   1.703  0.00  0.00    +0.111 A 
ATOM     11  C   LIG    1        5.050  -0.061   0.696  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1        4.406  -0.598  -0.413  0.00  0.00    +0.017 A 
ATOM     13  O   LIG    1        2.879  -1.629  -2.569  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1        0.835   0.057   0.546  0.00  0.00    +0.025 A 
ATOM     15  C   LIG    1        0.056   0.604   1.567  0.00  0.00    +0.014 A 
ATOM     16  C   LIG    1       -1.346   0.621   1.475  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1       -4.063  -0.017  -1.033  0.00  0.00    +0.129 C 
ATOM     18  N   LIG    1       -3.433   0.115   0.281  0.00  0.00    -0.336 N 
ATOM     19  C   LIG    1       -4.204   0.861   1.275  0.00  0.00    +0.129 C 
ENDBRANCH   1  18
TORSDOF 1