REMARK  Name = BDB014735
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.982  -5.190   1.401  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -2.739  -4.356   1.228  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -2.907  -2.994   1.010  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1       -1.665  -2.200   0.945  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -1.922  -0.862   0.351  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -1.032   0.174  -0.038  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1       -1.714   1.216  -0.526  0.00  0.00    -0.155 NA
ATOM      8  N   LIG    1       -3.012   0.864  -0.448  0.00  0.00    -0.266 N 
ATOM      9  C   LIG    1       -3.183  -0.377   0.079  0.00  0.00    +0.047 A 
ATOM     10  C   LIG    1       -4.443  -1.120   0.310  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1       -4.164  -2.269   1.303  0.00  0.00    +0.114 C 
ATOM     12  O   LIG    1       -1.628  -4.886   1.270  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   6  13
ATOM     13  N   LIG    1        0.314   0.046   0.079  0.00  0.00    -0.298 N 
ATOM     14  H   LIG    1        0.665  -0.839   0.421  0.00  0.00    +0.154 HD
BRANCH  13  15
ATOM     15  C   LIG    1        1.365   0.967  -0.141  0.00  0.00    +0.033 A 
ATOM     16  C   LIG    1        2.687   0.491  -0.129  0.00  0.00    +0.036 A 
ATOM     17  C   LIG    1        3.767   1.351  -0.374  0.00  0.00    +0.039 A 
ATOM     18  C   LIG    1        3.540   2.709  -0.607  0.00  0.00    +0.016 A 
ATOM     19  C   LIG    1        2.236   3.208  -0.623  0.00  0.00    -0.048 A 
ATOM     20  C   LIG    1        1.977   4.656  -0.920  0.00  0.00    +0.044 C 
ATOM     21  C   LIG    1        1.162   2.327  -0.413  0.00  0.00    +0.026 A 
BRANCH  17  22
ATOM     22  C   LIG    1        5.170   0.860  -0.373  0.00  0.00    +0.244 C 
ATOM     23  N   LIG    1        5.368  -0.411  -0.873  0.00  0.00    -0.309 N 
ATOM     24  H   LIG    1        4.586  -0.929  -1.251  0.00  0.00    +0.149 HD
ATOM     25  O   LIG    1        6.074   1.581   0.031  0.00  0.00    -0.270 OA
BRANCH  23  26
ATOM     26  C   LIG    1        6.682  -1.039  -0.877  0.00  0.00    +0.067 C 
ATOM     27  C   LIG    1        6.761  -2.090  -1.979  0.00  0.00    +0.027 C 
ATOM     28  C   LIG    1        6.979  -1.661   0.485  0.00  0.00    +0.027 C 
ENDBRANCH  23  26
ENDBRANCH  17  22
ENDBRANCH  13  15
ENDBRANCH   6  13
BRANCH   8  29
ATOM     29  C   LIG    1       -4.029   1.788  -0.933  0.00  0.00    +0.147 C 
BRANCH  29  30
ATOM     30  C   LIG    1       -4.361   2.839   0.084  0.00  0.00    +0.010 C 
ATOM     31  C   LIG    1       -5.518   2.676   1.038  0.00  0.00    +0.005 C 
ATOM     32  C   LIG    1       -5.602   3.680  -0.077  0.00  0.00    +0.005 C 
ENDBRANCH  29  30
ENDBRANCH   8  29
TORSDOF 6