REMARK  Name = BDB003758
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.763   0.156   0.212  0.00  0.00    +0.221 A 
ATOM      2  N   LIG    1       -2.870   0.759   0.666  0.00  0.00    -0.195 NA
ATOM      3  C   LIG    1       -4.057   0.096   0.644  0.00  0.00    +0.163 A 
ATOM      4  N   LIG    1       -5.196   0.780   1.144  0.00  0.00    -0.326 N 
ATOM      5  C   LIG    1       -6.334   0.930   0.327  0.00  0.00    +0.056 A 
ATOM      6  C   LIG    1       -7.003  -0.189  -0.183  0.00  0.00    +0.063 A 
ATOM      7  C   LIG    1       -6.656  -1.580   0.188  0.00  0.00    +0.261 A 
ATOM      8  N   LIG    1       -5.331  -2.029   0.238  0.00  0.00    -0.307 N 
ATOM      9  C   LIG    1       -5.147  -3.478   0.327  0.00  0.00    +0.152 C 
ATOM     10  O   LIG    1       -7.609  -2.353   0.337  0.00  0.00    -0.267 OA
ATOM     11  C   LIG    1       -8.136  -0.033  -1.010  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1       -8.604   1.232  -1.354  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -7.950   2.351  -0.863  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -6.835   2.200  -0.033  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -4.842   1.907   2.013  0.00  0.00    +0.151 C 
ATOM     16  C   LIG    1       -4.153  -1.216   0.184  0.00  0.00    +0.106 A 
ATOM     17  C   LIG    1       -2.945  -1.740  -0.251  0.00  0.00    +0.144 A 
ATOM     18  N   LIG    1       -1.766  -1.090  -0.256  0.00  0.00    -0.220 NA
ENDROOT
BRANCH   1  19
ATOM     19  N   LIG    1       -0.608   0.930   0.263  0.00  0.00    -0.284 N 
ATOM     20  H   LIG    1       -0.833   1.831   0.655  0.00  0.00    +0.155 HD
BRANCH  19  24
ATOM     21  C   LIG    1        3.523   0.359  -0.662  0.00  0.00    +0.032 A 
ATOM     22  C   LIG    1        2.591  -0.674  -0.826  0.00  0.00    +0.025 A 
ATOM     23  C   LIG    1        1.229  -0.515  -0.525  0.00  0.00    +0.025 A 
ATOM     24  C   LIG    1        0.734   0.696  -0.048  0.00  0.00    +0.034 A 
ATOM     25  C   LIG    1        1.652   1.742   0.100  0.00  0.00    +0.025 A 
ATOM     26  C   LIG    1        3.013   1.578  -0.205  0.00  0.00    +0.025 A 
BRANCH  21  28
ATOM     27  C   LIG    1        5.660  -0.846  -0.249  0.00  0.00    +0.220 C 
ATOM     28  N   LIG    1        4.858   0.154  -1.002  0.00  0.00    -0.302 N 
ATOM     29  C   LIG    1        5.668   1.301  -1.461  0.00  0.00    +0.123 C 
ATOM     30  C   LIG    1        6.507   1.938  -0.323  0.00  0.00    +0.103 C 
ATOM     31  N   LIG    1        7.324   1.000   0.478  0.00  0.00    -0.300 NA
ATOM     32  C   LIG    1        8.501   0.545  -0.259  0.00  0.00    +0.105 C 
ATOM     33  C   LIG    1        6.464  -0.139   0.891  0.00  0.00    +0.135 C 
BRANCH  27  35
ATOM     34  C   LIG    1        5.556  -3.143   0.344  0.00  0.00    +0.196 C 
ATOM     35  O   LIG    1        4.872  -1.901   0.302  0.00  0.00    -0.361 OA
ENDBRANCH  27  35
ENDBRANCH  21  28
ENDBRANCH  19  24
ENDBRANCH   1  19
TORSDOF 4