REMARK  Name = BDB015738
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.732  -1.320   0.375  0.00  0.00    +0.326 A 
ATOM      2  N   LIG    1       -1.448  -0.319  -0.157  0.00  0.00    -0.194 NA
ATOM      3  C   LIG    1       -0.754   0.647  -0.786  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1        0.624   0.628  -0.859  0.00  0.00    +0.072 A 
ATOM      5  C   LIG    1        1.270  -0.422  -0.242  0.00  0.00    +0.127 A 
ATOM      6  N   LIG    1        0.606  -1.403   0.377  0.00  0.00    -0.180 NA
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -1.550   1.732  -1.416  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1       -2.759   1.430  -1.929  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1       -3.569   2.379  -2.537  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1       -4.853   1.950  -3.068  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -3.193   3.712  -2.657  0.00  0.00    +0.251 A 
ATOM     12  O   LIG    1       -3.859   4.594  -3.192  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -1.872   4.060  -2.073  0.00  0.00    +0.071 A 
ATOM     14  C   LIG    1       -1.115   3.120  -1.492  0.00  0.00    +0.017 A 
ENDBRANCH   3   7
BRANCH   5  15
ATOM     15  N   LIG    1        2.655  -0.552  -0.253  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1        2.867  -1.414   0.248  0.00  0.00    +0.148 HD
BRANCH  15  17
ATOM     17  C   LIG    1        3.431   0.573   0.255  0.00  0.00    +0.103 C 
ATOM     18  C   LIG    1        4.896   0.234   0.176  0.00  0.00    -0.024 A 
ATOM     19  C   LIG    1        5.402  -0.126   1.431  0.00  0.00    -0.042 A 
ATOM     20  C   LIG    1        6.724  -0.506   1.588  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        7.550  -0.509   0.462  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        7.045  -0.150  -0.798  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        4.326  -0.092   2.469  0.00  0.00    +0.037 C 
ATOM     24  C   LIG    1        5.707   0.220  -0.949  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1        3.268   0.781   1.777  0.00  0.00    +0.032 C 
ENDBRANCH  15  17
ENDBRANCH   5  15
BRANCH   1  26
ATOM     26  O   LIG    1       -1.382  -2.339   1.061  0.00  0.00    -0.420 OA
BRANCH  26  29
ATOM     27  C   LIG    1       -3.191  -1.782   3.187  0.00  0.00    +0.047 C 
ATOM     28  C   LIG    1       -3.647  -2.241   1.832  0.00  0.00    -0.005 A 
ATOM     29  C   LIG    1       -2.725  -2.479   0.802  0.00  0.00    +0.170 A 
ATOM     30  C   LIG    1       -3.165  -2.921  -0.448  0.00  0.00    +0.166 A 
ATOM     31  F   LIG    1       -2.283  -3.190  -1.422  0.00  0.00    -0.202 F 
ATOM     32  C   LIG    1       -4.521  -3.094  -0.704  0.00  0.00    +0.042 A 
ATOM     33  C   LIG    1       -5.448  -2.836   0.304  0.00  0.00    +0.003 A 
ATOM     34  C   LIG    1       -5.014  -2.413   1.564  0.00  0.00    +0.007 A 
ENDBRANCH  26  29
ENDBRANCH   1  26
TORSDOF 5