REMARK  Name = BDB024778
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.664  -1.760  -0.813  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1       -4.970  -0.828  -0.020  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1       -5.722   0.137   0.820  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1       -6.409  -0.569   2.003  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1       -4.882   1.285   1.401  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1       -3.863   1.767   0.395  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1       -2.972   0.606   0.068  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -1.577   0.756  -0.081  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -0.804   1.885   0.058  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        0.438   1.511  -0.174  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1        0.489   0.167  -0.474  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1       -0.789  -0.338  -0.415  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1       -1.322  -1.611  -0.613  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1       -2.709  -1.750  -0.471  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1       -3.544  -0.670  -0.143  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1       -5.165  -2.575  -1.582  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1       -7.776  -2.553  -1.484  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1       -7.021  -1.646  -0.680  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1        1.680  -0.595  -0.812  0.00  0.00    +0.139 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.300  -1.263   0.425  0.00  0.00    +0.106 C 
BRANCH  20  21
ATOM     21  N   LIG    1        3.586  -1.945   0.221  0.00  0.00    -0.301 NA
ATOM     22  C   LIG    1        3.577  -2.963  -0.819  0.00  0.00    +0.085 C 
ATOM     23  C   LIG    1        4.783  -3.894  -0.649  0.00  0.00    +0.033 C 
ATOM     24  C   LIG    1        6.056  -3.164  -0.187  0.00  0.00    +0.094 C 
ATOM     25  C   LIG    1        5.970  -1.666  -0.486  0.00  0.00    +0.033 C 
ATOM     26  C   LIG    1        4.720  -1.021   0.129  0.00  0.00    +0.085 C 
BRANCH  24  27
ATOM     27  C   LIG    1        6.312  -3.396   1.250  0.00  0.00    +0.066 C 
ATOM     28  N   LIG    1        6.546  -3.584   2.371  0.00  0.00    -0.196 NA
ENDBRANCH  24  27
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  29
ATOM     29  C   LIG    1        1.634   2.406  -0.143  0.00  0.00    +0.097 C 
BRANCH  29  30
ATOM     30  C   LIG    1        1.382   3.664   0.681  0.00  0.00    +0.151 C 
BRANCH  30  31
ATOM     31  N   LIG    1        2.520   4.565   0.646  0.00  0.00    -0.271 N 
ATOM     32  N   LIG    1        3.723   4.147   1.091  0.00  0.00    -0.180 NA
ATOM     33  C   LIG    1        4.508   5.214   0.924  0.00  0.00    +0.134 A 
ATOM     34  C   LIG    1        3.819   6.304   0.362  0.00  0.00    +0.041 A 
ATOM     35  C   LIG    1        2.533   5.852   0.191  0.00  0.00    +0.108 A 
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  10  29
TORSDOF 8