REMARK  Name = BDB010907
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.532   0.651  -0.962  0.00  0.00    -0.322 N 
ATOM      2  C   LIG    1        1.599   0.150  -0.242  0.00  0.00    +0.114 A 
ATOM      3  C   LIG    1        2.401   1.260  -0.013  0.00  0.00    +0.183 A 
ATOM      4  N   LIG    1        3.539   1.245   0.695  0.00  0.00    -0.202 NA
ATOM      5  C   LIG    1        3.843   0.035   1.173  0.00  0.00    +0.220 A 
ATOM      6  N   LIG    1        3.144  -1.107   0.999  0.00  0.00    -0.221 NA
ATOM      7  N   LIG    1        1.894   2.375  -0.604  0.00  0.00    -0.209 NA
ATOM      8  C   LIG    1        2.008  -1.078   0.268  0.00  0.00    +0.102 A 
ATOM      9  C   LIG    1        0.781   1.992  -1.195  0.00  0.00    +0.150 A 
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1        5.076  -0.073   1.980  0.00  0.00    +0.287 A 
ATOM     11  O   LIG    1        5.780   1.077   2.148  0.00  0.00    -0.385 OA
ATOM     12  C   LIG    1        6.841   0.704   2.911  0.00  0.00    +0.436 A 
ATOM     13  O   LIG    1        7.735   1.434   3.300  0.00  0.00    -0.221 OA
ATOM     14  N   LIG    1        6.697  -0.635   3.143  0.00  0.00    -0.208 N 
ATOM     15  H   LIG    1        7.331  -1.208   3.683  0.00  0.00    +0.195 HD
ATOM     16  N   LIG    1        5.577  -1.129   2.554  0.00  0.00    -0.127 NA
ENDBRANCH   5  10
BRANCH   8  17
ATOM     17  C   LIG    1        1.344  -2.353   0.072  0.00  0.00    +0.022 A 
ATOM     18  C   LIG    1        1.401  -3.035  -1.152  0.00  0.00    +0.033 A 
ATOM     19  C   LIG    1        0.744  -4.254  -1.296  0.00  0.00    +0.060 A 
ATOM     20 CL   LIG    1        0.782  -5.092  -2.792  0.00  0.00    -0.082 Cl
ATOM     21  C   LIG    1        0.052  -4.766  -0.210  0.00  0.00    +0.130 A 
ATOM     22  N   LIG    1       -0.017  -4.149   0.993  0.00  0.00    -0.261 NA
ATOM     23  C   LIG    1        0.647  -2.973   1.109  0.00  0.00    +0.120 A 
ENDBRANCH   8  17
BRANCH   9  24
ATOM     24  C   LIG    1       -0.130   2.994  -2.017  0.00  0.00    +0.169 C 
ATOM     25  C   LIG    1        0.623   4.222  -2.595  0.00  0.00    +0.048 C 
ATOM     26  C   LIG    1        0.199   5.024  -1.353  0.00  0.00    +0.007 C 
ATOM     27  C   LIG    1       -0.915   3.988  -1.122  0.00  0.00    +0.048 C 
ATOM     28  F   LIG    1       -0.875   2.313  -2.919  0.00  0.00    -0.234 F 
ENDBRANCH   9  24
BRANCH   1  29
ATOM     29  C   LIG    1       -0.655  -0.063  -1.396  0.00  0.00    +0.127 C 
BRANCH  29  34
ATOM     30  C   LIG    1       -5.310  -1.364   1.278  0.00  0.00    +0.007 C 
ATOM     31  C   LIG    1       -3.796  -1.384   1.059  0.00  0.00    -0.014 C 
ATOM     32  C   LIG    1       -3.178  -0.054   1.523  0.00  0.00    +0.003 C 
ATOM     33  C   LIG    1       -1.826   0.185   0.863  0.00  0.00    +0.005 C 
ATOM     34  C   LIG    1       -1.957   0.331  -0.667  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1       -3.151  -0.471  -1.226  0.00  0.00    +0.005 C 
ATOM     36  C   LIG    1       -3.443  -1.721  -0.402  0.00  0.00    +0.003 C 
ENDBRANCH  29  34
ENDBRANCH   1  29
TORSDOF 5