REMARK  Name = BDB056837
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.747   0.412  -0.194  0.00  0.00    +0.166 A 
ATOM      2  C   LIG    1       -1.530   0.758  -1.274  0.00  0.00    +0.083 A 
ATOM      3  C   LIG    1       -1.123   1.123  -2.646  0.00  0.00    +0.069 C 
ATOM      4  N   LIG    1       -2.856   0.722  -0.910  0.00  0.00    -0.214 NA
ATOM      5  C   LIG    1       -2.844   0.379   0.365  0.00  0.00    +0.231 A 
ATOM      6  O   LIG    1       -1.580   0.164   0.862  0.00  0.00    -0.436 OA
ENDROOT
BRANCH   5   7
ATOM      7  C   LIG    1       -3.947   0.181   1.305  0.00  0.00    +0.078 A 
ATOM      8  C   LIG    1       -5.220   0.737   1.093  0.00  0.00    +0.132 A 
ATOM      9  C   LIG    1       -6.253   0.556   2.022  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1       -6.042  -0.215   3.162  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -4.796  -0.792   3.384  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -3.759  -0.593   2.466  0.00  0.00    +0.017 A 
BRANCH   8  13
ATOM     13  O   LIG    1       -5.475   1.557   0.022  0.00  0.00    -0.494 OA
ATOM     14  C   LIG    1       -6.091   0.815  -1.031  0.00  0.00    +0.277 C 
ENDBRANCH   8  13
ENDBRANCH   5   7
BRANCH   1  15
ATOM     15  C   LIG    1        0.709   0.288   0.046  0.00  0.00    +0.305 C 
BRANCH  15  16
ATOM     16  O   LIG    1        1.251  -0.435  -1.059  0.00  0.00    -0.484 OA
BRANCH  16  19
ATOM     17  C   LIG    1        4.873  -0.525  -0.217  0.00  0.00    +0.062 A 
ATOM     18  C   LIG    1        3.505  -0.233  -0.087  0.00  0.00    +0.060 A 
ATOM     19  C   LIG    1        2.601  -0.651  -1.064  0.00  0.00    +0.122 A 
ATOM     20  C   LIG    1        3.070  -1.361  -2.172  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1        4.427  -1.653  -2.311  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1        5.330  -1.238  -1.333  0.00  0.00    +0.015 A 
BRANCH  17  23
ATOM     23  C   LIG    1        5.792  -0.052   0.855  0.00  0.00    +0.339 C 
ATOM     24  O   LIG    1        5.422   0.613   1.810  0.00  0.00    -0.245 OA
BRANCH  23  26
ATOM     25  C   LIG    1        8.002  -0.046   1.609  0.00  0.00    +0.280 C 
ATOM     26  O   LIG    1        7.062  -0.464   0.618  0.00  0.00    -0.464 OA
ENDBRANCH  23  26
ENDBRANCH  17  23
ENDBRANCH  16  19
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 7