REMARK  Name = BDB014659
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.745  -0.047   1.388  0.00  0.00    +0.214 C 
ATOM      2  N   LIG    1        0.042   1.136   1.459  0.00  0.00    -0.313 N 
ATOM      3  H   LIG    1        0.522   2.013   1.296  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        0.235  -1.142   1.597  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   1   5
ATOM      5  C   LIG    1        2.196   0.148   1.014  0.00  0.00    +0.103 C 
BRANCH   5   6
ATOM      6  C   LIG    1        2.935  -1.185   0.965  0.00  0.00    +0.083 C 
BRANCH   6   9
ATOM      7  C   LIG    1        5.018  -3.416   0.950  0.00  0.00    +0.150 C 
ATOM      8  N   LIG    1        5.281  -2.044   0.590  0.00  0.00    -0.337 N 
ATOM      9  C   LIG    1        4.370  -1.015   0.582  0.00  0.00    +0.111 A 
ATOM     10  N   LIG    1        4.946   0.103   0.184  0.00  0.00    -0.232 NA
ATOM     11  C   LIG    1        6.266  -0.208  -0.064  0.00  0.00    +0.089 A 
ATOM     12  C   LIG    1        6.488  -1.545   0.185  0.00  0.00    +0.115 A 
BRANCH  11  13
ATOM     13  C   LIG    1        7.238   0.766  -0.537  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1        8.615   0.500  -0.552  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1        9.522   1.457  -1.018  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1        9.064   2.692  -1.473  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        7.700   2.974  -1.460  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        6.795   2.017  -0.994  0.00  0.00    +0.010 A 
ENDBRANCH  11  13
ENDBRANCH   6   9
ENDBRANCH   5   6
ENDBRANCH   1   5
BRANCH   2  19
ATOM     19  C   LIG    1       -1.369   1.170   1.817  0.00  0.00    +0.136 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.280   0.794   0.635  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -2.019   1.729  -0.425  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -1.113   1.531  -0.723  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -3.767   0.871   1.059  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.705   0.113   0.198  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -6.045   0.106   0.824  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -7.131  -0.505  -0.036  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.970  -0.621  -1.426  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -8.003  -1.157  -2.206  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -9.200  -1.554  -1.612  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -9.371  -1.424  -0.236  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -5.662  -0.231  -2.062  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -8.344  -0.899   0.549  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -4.801   0.668  -1.161  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 9