REMARK  Name = BDB032457
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.947  -1.649  -0.775  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.555  -1.724  -0.199  0.00  0.00    -0.024 A 
ATOM      3  C   LIG    1        0.538  -1.179  -0.880  0.00  0.00    +0.072 A 
ATOM      4  C   LIG    1        1.791  -1.250  -0.291  0.00  0.00    +0.215 A 
ATOM      5  N   LIG    1        2.025  -1.818   0.908  0.00  0.00    -0.221 NA
ATOM      6  C   LIG    1        0.956  -2.328   1.557  0.00  0.00    +0.115 A 
ATOM      7  C   LIG    1       -0.334  -2.303   1.054  0.00  0.00    +0.025 A 
BRANCH   4   8
ATOM      8  O   LIG    1        2.831  -0.686  -1.002  0.00  0.00    -0.473 OA
BRANCH   8   9
ATOM      9  C   LIG    1        4.104  -0.714  -0.336  0.00  0.00    +0.184 C 
ATOM     10  C   LIG    1        4.211   0.434   0.685  0.00  0.00    +0.119 C 
ATOM     11  C   LIG    1        5.622   0.722   1.069  0.00  0.00    +0.113 A 
ATOM     12  N   LIG    1        6.685   0.277   0.326  0.00  0.00    -0.334 N 
ATOM     13  C   LIG    1        7.832   0.724   0.907  0.00  0.00    +0.107 A 
ATOM     14  C   LIG    1        7.411   1.437   2.006  0.00  0.00    +0.130 A 
ATOM     15  C   LIG    1        6.571  -0.566  -0.844  0.00  0.00    +0.126 C 
ATOM     16  N   LIG    1        6.042   1.429   2.098  0.00  0.00    -0.240 NA
ATOM     17  C   LIG    1        5.166  -0.543  -1.434  0.00  0.00    +0.066 C 
ENDBRANCH   8   9
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  N   LIG    1       -2.681  -0.596  -0.088  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1       -2.111   0.241   0.016  0.00  0.00    +0.146 HD
BRANCH  18  23
ATOM     20  C   LIG    1       -6.526   2.412   0.260  0.00  0.00    +0.124 A 
ATOM     21  C   LIG    1       -5.948   1.244  -0.300  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -4.625   0.900   0.082  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1       -3.991  -0.255  -0.483  0.00  0.00    +0.035 A 
ATOM     24  C   LIG    1       -4.739  -1.081  -1.336  0.00  0.00    +0.023 A 
ATOM     25  C   LIG    1       -6.039  -0.751  -1.707  0.00  0.00    +0.003 A 
ATOM     26  C   LIG    1       -3.995   1.730   1.028  0.00  0.00    +0.030 A 
ATOM     27  C   LIG    1       -4.654   2.843   1.518  0.00  0.00    +0.113 A 
ATOM     28  C   LIG    1       -6.631   0.404  -1.206  0.00  0.00    +0.012 A 
ATOM     29  N   LIG    1       -5.893   3.201   1.146  0.00  0.00    -0.240 NA
BRANCH  20  30
ATOM     30  N   LIG    1       -7.828   2.818  -0.077  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1       -8.482   2.085   0.179  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1       -7.881   2.975  -1.078  0.00  0.00    +0.144 HD
ENDBRANCH  20  30
ENDBRANCH  18  23
ENDBRANCH   1  18
TORSDOF 6