@MOLECULE FDBD02273 45 46 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.3230 0.2687 -1.7627 C.3 1 UNK -0.0585 2 C1 0.4073 -0.8526 -0.7251 C.3 1 UNK -0.0144 3 C2 -0.9232 -1.2713 -0.0963 C.3 1 UNK -0.0585 4 C3 1.4586 -1.9421 -0.9462 C.3 1 UNK -0.0033 5 C4 2.3317 -1.8286 -2.1692 C.2 1 UNK -0.0752 6 C5 2.3073 -2.7689 -3.0810 C.2 1 UNK 0.0146 7 C6 1.2868 -3.8746 -2.9959 C.3 1 UNK 0.4106 8 F 0.0759 -3.3563 -2.5245 F 1 UNK -0.1665 9 F1 1.0938 -4.4296 -4.2655 F 1 UNK -0.1665 10 F2 1.7435 -4.8642 -2.1188 F 1 UNK -0.1665 11 C7 1.6541 -0.9035 0.1603 C.3 1 UNK 0.0688 12 C8 2.7051 0.1545 -0.0564 C.2 1 UNK 0.3116 13 O 2.4050 1.3238 -0.0043 O.2 1 UNK -0.2505 14 O1 3.9746 -0.2020 -0.3073 O.3 1 UNK -0.4595 15 C9 4.9334 0.8702 -0.5057 C.3 1 UNK 0.1230 16 C10 6.2953 0.2831 -0.7736 C.ar 1 UNK 0.0657 17 C11 7.1528 0.0159 0.2792 C.ar 1 UNK 0.1680 18 C12 8.4055 -0.5247 0.0329 C.ar 1 UNK 0.1670 19 C13 8.7984 -0.7972 -1.2658 C.ar 1 UNK 0.0540 20 C14 10.1600 -1.3848 -1.5336 C.3 1 UNK 0.0779 21 O2 10.0755 -2.8112 -1.5137 O.3 1 UNK -0.3782 22 C15 11.3195 -3.4705 -1.7581 C.3 1 UNK 0.0369 23 C16 7.9406 -0.5304 -2.3186 C.ar 1 UNK 0.1670 24 C17 6.6861 0.0057 -2.0718 C.ar 1 UNK 0.1680 25 F3 5.8485 0.2657 -3.0995 F 1 UNK -0.2020 26 F4 8.3241 -0.7964 -3.5864 F 1 UNK -0.2020 27 F5 9.2429 -0.7851 1.0606 F 1 UNK -0.2020 28 F6 6.7695 0.2823 1.5470 F 1 UNK -0.2020 29 H -0.4491 0.9551 -1.4842 H 1 UNK 0.0235 30 H1 0.0997 -0.1492 -2.7221 H 1 UNK 0.0235 31 H2 1.2595 0.7843 -1.8075 H 1 UNK 0.0235 32 H3 -1.5579 -0.4151 -0.0013 H 1 UNK 0.0235 33 H4 -0.7439 -1.6914 0.8713 H 1 UNK 0.0235 34 H5 -1.3983 -2.0002 -0.7191 H 1 UNK 0.0235 35 H6 1.4440 -3.0112 -0.9871 H 1 UNK 0.0356 36 H7 2.9489 -1.0101 -2.2884 H 1 UNK 0.0575 37 H8 2.9868 -2.7525 -3.8575 H 1 UNK 0.0657 38 H9 1.8329 -0.9448 1.2144 H 1 UNK 0.0425 39 H10 4.9742 1.4793 0.3730 H 1 UNK 0.0750 40 H11 4.6322 1.4680 -1.3404 H 1 UNK 0.0750 41 H12 10.8444 -1.0575 -0.7791 H 1 UNK 0.0612 42 H13 10.5056 -1.0613 -2.4932 H 1 UNK 0.0612 43 H14 11.1738 -4.5301 -1.7269 H 1 UNK 0.0524 44 H15 12.0275 -3.1856 -1.0081 H 1 UNK 0.0524 45 H16 11.6887 -3.1895 -2.7223 H 1 UNK 0.0524 @BOND 1 1 2 1 2 2 11 1 3 2 3 1 4 2 4 1 5 4 5 1 6 4 11 1 7 5 6 2 8 6 7 1 9 7 8 1 10 7 9 1 11 7 10 1 12 11 12 1 13 12 13 2 14 12 14 1 15 14 15 1 16 15 16 1 17 16 24 ar 18 16 17 ar 19 17 18 ar 20 17 28 1 21 18 19 ar 22 18 27 1 23 19 20 1 24 19 23 ar 25 20 21 1 26 21 22 1 27 23 24 ar 28 23 26 1 29 24 25 1 30 1 29 1 31 1 30 1 32 1 31 1 33 3 32 1 34 3 33 1 35 3 34 1 36 4 35 1 37 5 36 1 38 6 37 1 39 11 38 1 40 15 39 1 41 15 40 1 42 20 41 1 43 20 42 1 44 22 43 1 45 22 44 1 46 22 45 1