REMARK  Name = BDB019041
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.750  -0.409   0.298  0.00  0.00    +0.030 A 
ATOM      2  C   LIG    1        1.190   0.871   0.017  0.00  0.00    +0.090 A 
ATOM      3  N   LIG    1       -0.164   0.887  -0.281  0.00  0.00    -0.270 N 
ATOM      4  C   LIG    1       -0.521   2.194  -0.480  0.00  0.00    +0.207 A 
ATOM      5  N   LIG    1        0.503   3.006  -0.372  0.00  0.00    -0.230 NA
ATOM      6  C   LIG    1       -0.970  -0.270  -0.334  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1       -0.434  -1.429  -0.063  0.00  0.00    -0.223 NA
ATOM      8  C   LIG    1        1.579   2.198  -0.061  0.00  0.00    +0.152 A 
ATOM      9  C   LIG    1        0.908  -1.466   0.246  0.00  0.00    +0.125 A 
ENDROOT
BRANCH   1  15
ATOM     10  C   LIG    1        7.051  -1.759   1.852  0.00  0.00    +0.088 C 
ATOM     11  C   LIG    1        5.656  -1.414   1.433  0.00  0.00    +0.126 A 
ATOM     12  N   LIG    1        5.389  -1.395   0.113  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1        4.135  -1.042  -0.263  0.00  0.00    +0.050 A 
ATOM     14  C   LIG    1        3.877  -1.019  -1.742  0.00  0.00    +0.066 C 
ATOM     15  C   LIG    1        3.142  -0.719   0.655  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1        3.537  -0.766   1.982  0.00  0.00    +0.123 A 
ATOM     17  N   LIG    1        4.773  -1.110   2.400  0.00  0.00    -0.240 NA
ENDBRANCH   1  15
BRANCH   8  18
ATOM     18  C   LIG    1        3.014   2.801   0.159  0.00  0.00    +0.248 A 
ATOM     19  O   LIG    1        3.275   4.150   0.056  0.00  0.00    -0.442 OA
ATOM     20  C   LIG    1        4.606   4.264   0.309  0.00  0.00    +0.217 A 
ATOM     21  C   LIG    1        5.099   3.010   0.550  0.00  0.00    +0.153 A 
ATOM     22  N   LIG    1        4.088   2.091   0.453  0.00  0.00    -0.216 NA
ENDBRANCH   8  18
BRANCH   6  23
ATOM     23  N   LIG    1       -2.304  -0.144  -0.664  0.00  0.00    -0.310 N 
ATOM     24  H   LIG    1       -2.561   0.644  -1.247  0.00  0.00    +0.149 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -3.114  -1.320  -0.937  0.00  0.00    +0.143 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -4.559  -0.918  -1.007  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1       -5.314  -0.658   0.133  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -4.950  -0.773   1.566  0.00  0.00    +0.080 C 
ATOM     29  C   LIG    1       -6.149  -0.056   2.184  0.00  0.00    +0.234 C 
ATOM     30  O   LIG    1       -7.255  -0.091   1.252  0.00  0.00    -0.491 OA
ATOM     31  C   LIG    1       -6.650  -0.290   0.038  0.00  0.00    +0.124 A 
ATOM     32  C   LIG    1       -7.294  -0.161  -1.175  0.00  0.00    +0.049 A 
ATOM     33  C   LIG    1       -6.553  -0.397  -2.333  0.00  0.00    +0.042 A 
ATOM     34  C   LIG    1       -5.204  -0.766  -2.241  0.00  0.00    +0.129 A 
ATOM     35  F   LIG    1       -4.520  -0.974  -3.376  0.00  0.00    -0.205 F 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 5