REMARK  Name = BDB013243
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.753   0.551  -0.339  0.00  0.00    +0.047 A 
ATOM      2  C   LIG    1        2.025  -0.253  -1.253  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1        0.666  -0.328  -1.074  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        0.206  -1.101  -2.099  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        1.216  -1.519  -2.829  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -0.007   0.332  -0.041  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        0.661   1.094   0.782  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        2.368  -0.983  -2.294  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        2.031   1.176   0.618  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  11
ATOM     10  CA  LIG    1        5.127  -0.279  -0.057  0.00  0.00    +0.074 A 
ATOM     11  C   LIG    1        4.216   0.741  -0.366  0.00  0.00    +0.011 A 
ATOM     12  C   LIG    1        4.740   1.995  -0.712  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1        6.117   2.196  -0.736  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1        6.940   1.135  -0.410  0.00  0.00    +0.111 A 
ATOM     15  N   LIG    1        6.483  -0.088  -0.070  0.00  0.00    -0.257 NA
BRANCH  10  16
ATOM     16  C   LIG    1        4.676  -1.677   0.314  0.00  0.00    +0.211 C 
BRANCH  16  17
ATOM     17  O   LIG    1        5.762  -2.437   0.852  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1        6.556  -1.892   0.669  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
ENDBRANCH  10  16
ENDBRANCH   1  11
BRANCH   6  19
ATOM     19  N   LIG    1       -1.373   0.212   0.094  0.00  0.00    -0.310 N 
ATOM     20  H   LIG    1       -1.684   0.942   0.748  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -1.934  -1.044   0.586  0.00  0.00    +0.143 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -3.441  -1.063   0.622  0.00  0.00    +0.014 A 
ATOM     23  C   LIG    1       -4.299  -0.001   0.330  0.00  0.00    +0.033 A 
ATOM     24  C   LIG    1       -4.016   1.391  -0.100  0.00  0.00    +0.186 C 
ATOM     25  C   LIG    1       -5.440   1.908  -0.351  0.00  0.00    +0.265 C 
ATOM     26  O   LIG    1       -6.399   0.995   0.226  0.00  0.00    -0.489 OA
ATOM     27  C   LIG    1       -5.676  -0.140   0.486  0.00  0.00    +0.127 A 
ATOM     28  C   LIG    1       -6.266  -1.317   0.906  0.00  0.00    +0.049 A 
ATOM     29  C   LIG    1       -5.434  -2.398   1.178  0.00  0.00    +0.042 A 
ATOM     30  C   LIG    1       -4.048  -2.261   1.040  0.00  0.00    +0.129 A 
ATOM     31  F   LIG    1       -3.275  -3.318   1.332  0.00  0.00    -0.205 F 
BRANCH  24  32
ATOM     32  O   LIG    1       -3.349   2.064   0.963  0.00  0.00    -0.384 OA
ATOM     33  H   LIG    1       -3.418   3.020   0.794  0.00  0.00    +0.210 HD
ENDBRANCH  24  32
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   6  19
TORSDOF 7