REMARK  Name = BDB008363
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.132  -0.056  -0.092  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.093  -1.360  -0.576  0.00  0.00    +0.135 A 
ATOM      3  F   LIG    1       -1.051  -2.241  -0.254  0.00  0.00    -0.205 F 
ATOM      4  C   LIG    1        0.940  -1.767  -1.413  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        1.959  -0.870  -1.744  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1        1.962   0.435  -1.224  0.00  0.00    -0.041 A 
ATOM      7  C   LIG    1        0.899   0.839  -0.402  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  16
ATOM      8  C   LIG    1       -4.774  -1.362   1.710  0.00  0.00    +0.032 C 
ATOM      9  C   LIG    1       -4.876   0.080   1.209  0.00  0.00    +0.105 C 
ATOM     10  N   LIG    1       -5.267   0.123  -0.188  0.00  0.00    -0.305 N 
ATOM     11  C   LIG    1       -4.368   0.227  -1.216  0.00  0.00    +0.151 A 
ATOM     12  N   LIG    1       -5.030   0.263  -2.353  0.00  0.00    -0.133 NA
ATOM     13  N   LIG    1       -6.373   0.208  -2.062  0.00  0.00    -0.128 NA
ATOM     14  C   LIG    1       -2.899   0.326  -1.011  0.00  0.00    +0.184 C 
ATOM     15  N   LIG    1       -2.530   0.333   0.416  0.00  0.00    -0.288 N 
ATOM     16  C   LIG    1       -1.196   0.379   0.828  0.00  0.00    +0.250 C 
ATOM     17  O   LIG    1       -0.844   0.796   1.930  0.00  0.00    -0.270 OA
ATOM     18  C   LIG    1       -6.512   0.143  -0.751  0.00  0.00    +0.200 A 
ATOM     19  C   LIG    1       -3.539   0.819   1.366  0.00  0.00    +0.133 C 
BRANCH  18  20
ATOM     20  C   LIG    1       -7.779   0.116   0.012  0.00  0.00    +0.408 C 
ATOM     21  F   LIG    1       -7.859   1.183   0.856  0.00  0.00    -0.201 F 
ATOM     22  F   LIG    1       -7.853  -0.987   0.807  0.00  0.00    -0.201 F 
ENDBRANCH  18  20
ENDBRANCH   1  16
BRANCH   6  23
ATOM     23  C   LIG    1        3.072   1.405  -1.565  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.467   0.833  -1.342  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1        5.024   0.737   0.033  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1        6.299   0.191   0.164  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1        6.895   0.060   1.425  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1        6.207   0.479   2.562  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        4.931   1.027   2.438  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        7.020  -0.251  -1.041  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1        8.144  -0.735  -0.973  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1        6.361  -0.086  -2.234  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1        6.845  -0.383  -3.075  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1        4.338   1.158   1.178  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1        5.117   0.437  -2.398  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   6  23
TORSDOF 4