REMARK  Name = BDB007666
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.369   1.208   1.780  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -0.484   0.341   1.640  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1       -0.222  -0.908   1.114  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1       -0.886  -1.651   1.294  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.882   0.599   2.072  0.00  0.00    +0.041 A 
ATOM      6  C   LIG    1       -2.968  -0.053   1.486  0.00  0.00    +0.056 A 
ATOM      7  C   LIG    1       -4.243   0.243   1.943  0.00  0.00    +0.120 A 
ATOM      8  N   LIG    1       -4.466   1.121   2.937  0.00  0.00    -0.240 NA
ATOM      9  C   LIG    1       -3.401   1.756   3.475  0.00  0.00    +0.113 A 
ATOM     10  C   LIG    1       -2.100   1.538   3.076  0.00  0.00    +0.033 A 
BRANCH   7  11
ATOM     11  N   LIG    1       -5.382  -0.370   1.426  0.00  0.00    -0.326 N 
ATOM     12  H   LIG    1       -6.144   0.020   1.984  0.00  0.00    +0.148 HD
BRANCH  11  13
ATOM     13  C   LIG    1       -5.623  -0.201  -0.015  0.00  0.00    +0.076 C 
ATOM     14  C   LIG    1       -6.740  -1.165  -0.447  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1       -8.074  -0.443  -0.529  0.00  0.00    +0.161 C 
ATOM     16  O   LIG    1       -8.059   0.618  -1.485  0.00  0.00    -0.380 OA
ATOM     17  C   LIG    1       -6.820   1.313  -1.610  0.00  0.00    +0.161 C 
ATOM     18  C   LIG    1       -5.977   1.256  -0.347  0.00  0.00    +0.050 C 
ENDBRANCH  11  13
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  19
ATOM     19  C   LIG    1        1.151  -1.325   0.831  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1        1.736  -0.619  -0.404  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1        0.863  -0.857  -1.523  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -0.010  -0.540  -1.229  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        3.144  -1.142  -0.762  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        4.147  -1.056   0.315  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        5.425  -1.671  -0.097  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        6.284  -0.822  -1.012  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        6.123   0.575  -1.065  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        6.954   1.340  -1.895  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        7.953   0.727  -2.649  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        8.127  -0.653  -2.584  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        5.019   1.243  -0.282  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        7.300  -1.424  -1.768  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        4.409   0.319   0.781  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 8