REMARK  Name = BDB003235
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.286   3.134  -1.595  0.00  0.00    +0.328 C 
ENDROOT
BRANCH   1   4
ATOM      2  N   LIG    1       -2.036   1.866  -0.475  0.00  0.00    -0.280 N 
ATOM      3  H   LIG    1       -1.702   1.125  -1.100  0.00  0.00    +0.155 HD
ATOM      4  C   LIG    1       -1.373   3.076  -0.517  0.00  0.00    +0.255 C 
ATOM      5  O   LIG    1       -1.592   4.047   0.204  0.00  0.00    -0.272 OA
BRANCH   2   7
ATOM      6  C   LIG    1       -3.557   0.141   0.243  0.00  0.00    +0.143 A 
ATOM      7  C   LIG    1       -3.091   1.470   0.376  0.00  0.00    +0.076 A 
ATOM      8  C   LIG    1       -3.679   2.317   1.319  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1       -4.719   1.858   2.132  0.00  0.00    +0.035 A 
ATOM     10  C   LIG    1       -5.173   0.543   1.995  0.00  0.00    +0.130 A 
ATOM     11  C   LIG    1       -4.598  -0.321   1.053  0.00  0.00    +0.080 A 
BRANCH  10  12
ATOM     12  N   LIG    1       -6.267   0.060   2.849  0.00  0.00    +0.057 N 
ATOM     13  O   LIG    1       -6.651  -1.107   2.687  0.00  0.00    -0.126 OA
ATOM     14  O   LIG    1       -6.742   0.847   3.680  0.00  0.00    -0.126 OA
ENDBRANCH  10  12
BRANCH   6  16
ATOM     15  C   LIG    1       -3.290  -1.978  -0.838  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1       -2.918  -0.611  -0.714  0.00  0.00    -0.493 OA
ENDBRANCH   6  16
ENDBRANCH   2   7
ENDBRANCH   1   4
BRANCH   1  17
ATOM     17  O   LIG    1        0.906   2.434  -1.234  0.00  0.00    -0.452 OA
BRANCH  17  18
ATOM     18  C   LIG    1        0.881   1.099  -1.461  0.00  0.00    +0.340 C 
ATOM     19  O   LIG    1       -0.069   0.484  -1.922  0.00  0.00    -0.245 OA
BRANCH  18  20
ATOM     20  C   LIG    1        2.164   0.466  -1.058  0.00  0.00    +0.059 A 
ATOM     21  C   LIG    1        3.215   1.192  -0.487  0.00  0.00    +0.017 A 
ATOM     22  C   LIG    1        4.401   0.543  -0.122  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1        4.555  -0.835  -0.322  0.00  0.00    +0.035 A 
ATOM     24  C   LIG    1        3.502  -1.556  -0.887  0.00  0.00    +0.024 A 
ATOM     25  C   LIG    1        2.314  -0.911  -1.254  0.00  0.00    +0.017 A 
BRANCH  23  26
ATOM     26  N   LIG    1        5.773  -1.414   0.079  0.00  0.00    -0.270 N 
ATOM     27  H   LIG    1        6.479  -0.793   0.445  0.00  0.00    +0.156 HD
ATOM     28  C   LIG    1        6.193  -2.701  -0.128  0.00  0.00    +0.301 C 
ATOM     29  O   LIG    1        5.640  -3.592  -0.753  0.00  0.00    -0.253 OA
ATOM     30  N   LIG    1        7.400  -2.937   0.465  0.00  0.00    -0.313 N 
ATOM     31  H   LIG    1        7.521  -2.563   1.395  0.00  0.00    +0.146 HD
ATOM     32  H   LIG    1        7.670  -3.912   0.390  0.00  0.00    +0.146 HD
ENDBRANCH  23  26
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 8