REMARK  Name = BDB032328
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.061   0.688   0.016  0.00  0.00    +0.122 A 
ATOM      2  N   LIG    1       -1.562   1.057   1.212  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.251   1.387   1.291  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1        0.626   1.368   0.217  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1        0.101   0.988  -1.017  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -1.247   0.648  -1.118  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1       -4.503   2.398   0.741  0.00  0.00    +0.036 C 
ATOM      8  C   LIG    1       -4.286   0.897   0.980  0.00  0.00    +0.140 C 
ATOM      9  N   LIG    1       -3.425   0.340  -0.113  0.00  0.00    -0.304 N 
ATOM     10  C   LIG    1       -3.562  -1.121  -0.281  0.00  0.00    +0.129 C 
ATOM     11  C   LIG    1       -5.010  -1.473  -0.638  0.00  0.00    +0.144 C 
ATOM     12  N   LIG    1       -5.931  -0.879   0.305  0.00  0.00    -0.305 N 
ATOM     13  C   LIG    1       -7.212  -1.244   0.616  0.00  0.00    +0.238 A 
ATOM     14  N   LIG    1       -7.658  -0.417   1.546  0.00  0.00    -0.125 NA
ATOM     15  N   LIG    1       -6.665   0.495   1.828  0.00  0.00    -0.132 NA
ATOM     16  C   LIG    1       -5.633   0.219   1.062  0.00  0.00    +0.154 A 
BRANCH  13  17
ATOM     17  C   LIG    1       -7.911  -2.384  -0.018  0.00  0.00    +0.452 C 
ATOM     18  F   LIG    1       -9.223  -2.474   0.310  0.00  0.00    -0.163 F 
ATOM     19  F   LIG    1       -7.334  -3.569   0.320  0.00  0.00    -0.163 F 
ATOM     20  F   LIG    1       -7.848  -2.312  -1.376  0.00  0.00    -0.163 F 
ENDBRANCH  13  17
ENDBRANCH   1   9
BRANCH   4  21
ATOM     21  C   LIG    1        2.069   1.764   0.374  0.00  0.00    +0.138 C 
BRANCH  21  22
ATOM     22  N   LIG    1        2.924   0.645  -0.007  0.00  0.00    -0.339 N 
ATOM     23  H   LIG    1        2.602  -0.223   0.414  0.00  0.00    +0.146 HD
BRANCH  22  24
ATOM     24  C   LIG    1        4.327   0.749   0.094  0.00  0.00    +0.035 A 
ATOM     25  C   LIG    1        5.140  -0.409  -0.129  0.00  0.00    +0.008 A 
ATOM     26  C   LIG    1        6.551  -0.309  -0.046  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1        7.317  -1.477  -0.255  0.00  0.00    +0.124 A 
ATOM     28  N   LIG    1        6.790  -2.685  -0.522  0.00  0.00    -0.240 NA
ATOM     29  C   LIG    1        5.451  -2.757  -0.615  0.00  0.00    +0.113 A 
ATOM     30  C   LIG    1        7.133   0.944   0.236  0.00  0.00    +0.012 A 
ATOM     31  C   LIG    1        6.348   2.079   0.395  0.00  0.00    +0.003 A 
ATOM     32  C   LIG    1        4.606  -1.675  -0.438  0.00  0.00    +0.030 A 
ATOM     33  C   LIG    1        4.962   1.983   0.307  0.00  0.00    +0.023 A 
BRANCH  27  34
ATOM     34  N   LIG    1        8.716  -1.465  -0.204  0.00  0.00    -0.343 N 
ATOM     35  H   LIG    1        9.009  -2.415  -0.420  0.00  0.00    +0.144 HD
ATOM     36  H   LIG    1        9.088  -0.805  -0.877  0.00  0.00    +0.144 HD
ENDBRANCH  27  34
ENDBRANCH  22  24
ENDBRANCH  21  22
ENDBRANCH   4  21
TORSDOF 6