REMARK  Name = BDB032447
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.002  -2.361  -1.153  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1        0.842  -0.089  -0.115  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1        0.908  -0.220   1.225  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1        0.015  -1.056   1.794  0.00  0.00    +0.115 A 
ATOM      5  C   LIG    1       -0.942  -1.766   1.085  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1       -1.010  -1.606  -0.302  0.00  0.00    -0.024 A 
ATOM      7  C   LIG    1       -0.080  -0.754  -0.909  0.00  0.00    +0.072 A 
BRANCH   2   8
ATOM      8  O   LIG    1        1.728   0.735  -0.779  0.00  0.00    -0.476 OA
BRANCH   8   9
ATOM      9  C   LIG    1        2.665   1.413   0.063  0.00  0.00    +0.234 C 
BRANCH   9  14
ATOM     10  C   LIG    1        7.492   1.204  -0.415  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1        6.830   0.083   0.247  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1        6.160   0.485   1.490  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1        4.875   1.288   1.275  0.00  0.00    +0.022 C 
ATOM     14  C   LIG    1        3.901   0.547   0.351  0.00  0.00    +0.029 C 
ATOM     15  C   LIG    1        4.612   0.128  -0.944  0.00  0.00    +0.022 C 
ATOM     16  C   LIG    1        5.909  -0.630  -0.646  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       -3.248  -2.657  -0.451  0.00  0.00    -0.339 N 
ATOM     18  H   LIG    1       -3.590  -3.592  -0.664  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -4.287  -1.725  -0.393  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1       -4.122  -0.349  -0.543  0.00  0.00    +0.034 A 
ATOM     21  C   LIG    1       -5.203   0.540  -0.388  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1       -6.462   0.016  -0.049  0.00  0.00    +0.110 A 
ATOM     23  C   LIG    1       -7.506   0.954   0.082  0.00  0.00    +0.142 A 
ATOM     24  N   LIG    1       -7.370   2.289  -0.093  0.00  0.00    -0.239 NA
ATOM     25  C   LIG    1       -6.142   2.741  -0.407  0.00  0.00    +0.113 A 
ATOM     26  N   LIG    1       -6.644  -1.317   0.122  0.00  0.00    -0.250 NA
ATOM     27  C   LIG    1       -5.041   1.920  -0.562  0.00  0.00    +0.030 A 
ATOM     28  C   LIG    1       -5.570  -2.130  -0.025  0.00  0.00    +0.134 A 
BRANCH  23  29
ATOM     29  N   LIG    1       -8.786   0.540   0.484  0.00  0.00    -0.341 N 
ATOM     30  H   LIG    1       -9.422   1.322   0.383  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1       -9.056  -0.305  -0.007  0.00  0.00    +0.144 HD
ENDBRANCH  23  29
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7