@<TRIPOS>MOLECULE
ZINC12921206_1_1
   30    33     0     0     0
SMALL
USER_CHARGES

@<TRIPOS>ATOM
      1 C1         10.8630   31.3859   32.2468           1 CAN         0.0000
      2 C2         11.5701   31.4080   33.4817           1 CAN         0.0000
      3 C3         17.5821   22.4473   38.5639           1 CAN         0.0000
      4 C4         17.9273   24.7114   37.0200           1 CAN         0.0000
      5 C5         10.5243   30.1190   31.8528           1 CAN         0.0000
      6 C6         12.3942   31.2627   36.0033           1 CAN         0.0000
      7 C7         12.3703   30.0954   35.2910           1 CAN         0.0000
      8 C8         12.7652   28.9134   36.0072           1 CAN         0.0000
      9 C9         16.4753   23.1064   38.0609           1 CAN         0.0000
     10 C10        16.6480   24.2419   37.2829           1 CAN         0.0000
     11 C11        18.8581   22.9199   38.3189           1 CAN         0.0000
     12 C12        19.0369   24.0561   37.5370           1 CAN         0.0000
     13 C13        11.8010   30.1533   33.9700           1 CAN         0.0000
     14 C14        12.9774   29.2537   37.3208           1 CAN         0.0000
     15 C15        13.3581   27.0671   37.7950           1 CAN         0.0000
     16 C16        13.0045   27.5630   35.4958           1 CAN         0.0000
     17 C17        14.5101   24.5014   36.0984           1 CAN         0.0000
     18 C18        15.0909   22.6148   38.4220           1 CAN         0.0000
     19 C19        19.6116   21.0974   39.7116           1 CAN         0.0000
     20 C20        21.4990   23.9541   37.7136           1 CAN         0.0000
     21 C21        13.2073   25.2763   36.0792           1 CAN         0.0000
     22 N1         13.3019   28.3134   38.2813           1 CAN         0.0000
     23 N2         13.2604   26.6887   36.4706           1 CAN         0.0000
     24 N3         15.5062   24.9862   36.8657           1 CAN         0.0000
     25 O1         13.0317   27.1909   34.3441           1 CAN         0.0000
     26 O2         14.6486   23.4801   35.4573           1 CAN         0.0000
     27 O3         19.9073   22.2497   38.8981           1 CAN         0.0000
     28 O4         20.2810   24.5742   37.2617           1 CAN         0.0000
     29 S1         11.0122   28.9270   33.0152           1 CAN         0.0000
     30 S2         12.7971   30.9513   37.6624           1 CAN         0.0000
@<TRIPOS>BOND
     1    1    2 0
     2    1    5 0
     3    2   13 0
     4    3   11 0
     5    3    9 0
     6    4   12 0
     7    4   10 0
     8    5   29 0
     9    6    7 0
    10    6   30 0
    11    7    8 0
    12    7   13 0
    13    8   14 0
    14    8   16 0
    15    9   10 0
    16    9   18 0
    17   10   24 0
    18   11   27 0
    19   11   12 0
    20   12   28 0
    21   13   29 0
    22   14   22 0
    23   14   30 0
    24   15   22 0
    25   15   23 0
    26   16   23 0
    27   16   25 0
    28   17   21 0
    29   17   24 0
    30   17   26 0
    31   19   27 0
    32   20   28 0
    33   21   23 0