REMARK  Name = BDB014738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.745  -4.333   1.090  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -4.276  -4.049   0.915  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -3.917  -2.785   0.463  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1       -2.477  -2.583   0.215  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -2.158  -1.136   0.091  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -0.914  -0.460  -0.013  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1       -1.111   0.857  -0.128  0.00  0.00    -0.155 NA
ATOM      8  N   LIG    1       -2.442   1.034  -0.067  0.00  0.00    -0.261 N 
ATOM      9  C   LIG    1       -3.114  -0.144   0.036  0.00  0.00    +0.048 A 
ATOM     10  C   LIG    1       -4.576  -0.376   0.111  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1       -4.859  -1.860  -0.204  0.00  0.00    +0.114 C 
ATOM     12  O   LIG    1       -3.442  -4.917   1.178  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -2.995   2.364  -0.130  0.00  0.00    +0.135 C 
ATOM     14  C   LIG    1       -2.880   3.011  -1.497  0.00  0.00    +0.186 C 
ATOM     15  O   LIG    1       -3.035   4.426  -1.283  0.00  0.00    -0.378 OA
ATOM     16  C   LIG    1       -2.802   4.696   0.109  0.00  0.00    +0.162 C 
ATOM     17  C   LIG    1       -2.334   3.406   0.751  0.00  0.00    +0.057 C 
ENDBRANCH   8  13
BRANCH   6  18
ATOM     18  N   LIG    1        0.270  -1.122   0.002  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1        0.237  -2.126   0.132  0.00  0.00    +0.154 HD
BRANCH  18  20
ATOM     20  C   LIG    1        1.601  -0.658  -0.093  0.00  0.00    +0.035 A 
ATOM     21  C   LIG    1        1.952   0.682  -0.264  0.00  0.00    +0.062 A 
ATOM     22  C   LIG    1        3.292   1.070  -0.353  0.00  0.00    +0.133 A 
ATOM     23  F   LIG    1        3.551   2.379  -0.508  0.00  0.00    -0.205 F 
ATOM     24  C   LIG    1        4.334   0.141  -0.274  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        3.990  -1.206  -0.109  0.00  0.00    +0.013 A 
ATOM     26  C   LIG    1        2.645  -1.595  -0.020  0.00  0.00    +0.024 A 
BRANCH  24  27
ATOM     27  C   LIG    1        5.725   0.557  -0.374  0.00  0.00    +0.022 A 
ATOM     28  C   LIG    1        6.809  -0.142   0.123  0.00  0.00    +0.116 A 
ATOM     29  N   LIG    1        7.916   0.599  -0.175  0.00  0.00    -0.274 N 
ATOM     30  C   LIG    1        9.286   0.282   0.146  0.00  0.00    +0.172 C 
ATOM     31  N   LIG    1        7.640   1.734  -0.836  0.00  0.00    -0.179 NA
ATOM     32  C   LIG    1        6.308   1.713  -0.948  0.00  0.00    +0.143 A 
ENDBRANCH  24  27
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 4