REMARK  Name = BDB014981
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.243   0.252  -2.489  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.057  -0.168  -2.521  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1       -1.702  -0.891  -1.518  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -3.044  -1.284  -1.665  0.00  0.00    -0.030 A 
ATOM      5  C   LIG    1       -3.727  -0.952  -2.844  0.00  0.00    +0.005 A 
ATOM      6  C   LIG    1       -3.078  -0.250  -3.858  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1       -1.747   0.134  -3.697  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1       -3.732  -2.062  -0.569  0.00  0.00    +0.116 C 
BRANCH   8   9
ATOM      9  N   LIG    1       -3.852  -1.327   0.693  0.00  0.00    -0.309 NA
ATOM     10  H   LIG    1       -4.207  -1.964   1.405  0.00  0.00    +0.123 HD
BRANCH   9  11
ATOM     11  C   LIG    1       -4.705  -0.132   0.635  0.00  0.00    +0.056 C 
ATOM     12  C   LIG    1       -4.513   0.666   1.942  0.00  0.00    +0.034 C 
ATOM     13  C   LIG    1       -5.755   1.472   2.336  0.00  0.00    +0.082 C 
ATOM     14  N   LIG    1       -6.478   1.975   1.172  0.00  0.00    -0.316 NA
ATOM     15  H   LIG    1       -5.843   2.547   0.614  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -6.991   0.880   0.342  0.00  0.00    +0.082 C 
ATOM     17  C   LIG    1       -6.193  -0.428   0.429  0.00  0.00    +0.034 C 
ENDBRANCH   9  11
ENDBRANCH   8   9
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1        0.829   0.512  -1.206  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.904  -0.537  -0.885  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1        1.298  -1.753  -0.423  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1        2.006  -2.212   0.073  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        2.855  -0.026   0.220  0.00  0.00    +0.119 C 
BRANCH  22  23
ATOM     23  N   LIG    1        3.792  -1.078   0.683  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1        4.517  -0.640   1.896  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        5.632   0.354   1.647  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1        6.252   0.444   0.388  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1        7.306   1.347   0.194  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1        7.757   2.140   1.249  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.157   2.039   2.502  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        5.747  -0.380  -0.770  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        6.103   1.149   2.703  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        4.781  -1.491  -0.331  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 9