@MOLECULE FDBD00069 62 66 0 0 0 SMALL GASTEIGER @ATOM 1 F -3.7151 2.6509 -1.4982 F 1 UNK -0.2407 2 O 2.8683 0.4674 1.2260 O.3 1 UNK -0.3320 3 O1 3.4258 2.2879 -0.1516 O.3 1 UNK -0.3426 4 O2 -0.7581 -2.8021 -0.7295 O.3 1 UNK -0.3914 5 O3 4.9253 -0.6609 -1.0407 O.2 1 UNK -0.2918 6 O4 5.2867 -2.5933 0.8921 O.3 1 UNK -0.3874 7 O5 -6.2678 0.4790 2.0806 O.2 1 UNK -0.2879 8 C 1.4655 -0.6465 -0.4848 C.3 1 UNK 0.0121 9 C1 0.5960 0.6266 -0.5855 C.3 1 UNK -0.0267 10 C2 -0.8501 0.3465 -1.0167 C.3 1 UNK -0.0284 11 C3 2.8276 -0.0023 -0.1191 C.3 1 UNK 0.1640 12 C4 -1.5168 -0.5924 0.0506 C.3 1 UNK 0.0009 13 C5 2.9007 1.2585 -0.9847 C.3 1 UNK 0.0987 14 C6 1.4538 1.5838 -1.4160 C.3 1 UNK -0.0196 15 C7 0.8376 -1.5475 0.5957 C.3 1 UNK -0.0177 16 C8 -0.6525 -1.8634 0.3318 C.3 1 UNK 0.0600 17 C9 -3.0478 -0.8450 -0.2511 C.3 1 UNK 0.0158 18 C10 -1.6329 1.6610 -1.1630 C.3 1 UNK -0.0143 19 C11 1.5991 -1.4078 -1.8322 C.3 1 UNK -0.0561 20 C12 -3.1076 1.4288 -1.4581 C.3 1 UNK 0.1235 21 C13 3.4215 1.7862 1.1863 C.3 1 UNK 0.1663 22 C14 4.0005 -0.9255 -0.2738 C.2 1 UNK 0.1931 23 C15 -3.7160 0.5275 -0.4128 C.2 1 UNK -0.0226 24 C16 -3.3087 -1.6612 -1.5374 C.3 1 UNK -0.0519 25 C17 -3.6781 -1.6351 0.8866 C.2 1 UNK -0.0701 26 C18 3.9752 -2.1876 0.5620 C.3 1 UNK 0.1053 27 C19 4.8549 1.7338 1.7015 C.3 1 UNK -0.0108 28 C20 2.5788 2.7158 2.0548 C.3 1 UNK -0.0108 29 C21 -4.7463 0.9439 0.3404 C.2 1 UNK -0.0122 30 C22 -4.7021 -1.2229 1.6397 C.2 1 UNK -0.0180 31 C23 -5.3172 0.0959 1.4071 C.2 1 UNK 0.1788 32 H -1.6933 -2.9998 -0.8945 H 1 UNK 0.2098 33 H1 5.2501 -3.4019 1.4266 H 1 UNK 0.2100 34 H2 0.3727 1.0963 0.3496 H 1 UNK 0.0311 35 H3 -0.8592 -0.1382 -1.9706 H 1 UNK 0.0308 36 H4 -1.5294 -0.0816 0.9907 H 1 UNK 0.0340 37 H5 3.5153 1.1490 -1.8537 H 1 UNK 0.0631 38 H6 1.2107 2.6020 -1.1944 H 1 UNK 0.0294 39 H7 1.3013 1.4657 -2.4685 H 1 UNK 0.0294 40 H8 0.9185 -1.0525 1.5409 H 1 UNK 0.0297 41 H9 1.3676 -2.4769 0.5833 H 1 UNK 0.0297 42 H10 -1.0519 -2.2873 1.2294 H 1 UNK 0.0596 43 H11 -1.2070 2.2270 -1.9650 H 1 UNK 0.0299 44 H12 -1.5652 2.1860 -0.2331 H 1 UNK 0.0299 45 H13 2.0368 -0.7622 -2.5647 H 1 UNK 0.0236 46 H14 0.6304 -1.7186 -2.1638 H 1 UNK 0.0236 47 H15 2.2221 -2.2670 -1.6962 H 1 UNK 0.0236 48 H16 -3.2400 0.9353 -2.3982 H 1 UNK 0.0699 49 H17 -2.8846 -1.1500 -2.3763 H 1 UNK 0.0241 50 H18 -4.3631 -1.7710 -1.6824 H 1 UNK 0.0241 51 H19 -2.8590 -2.6276 -1.4440 H 1 UNK 0.0241 52 H20 -3.2823 -2.5655 1.0935 H 1 UNK 0.0582 53 H21 3.4278 -2.0018 1.4624 H 1 UNK 0.0637 54 H22 3.5062 -2.9656 -0.0034 H 1 UNK 0.0637 55 H23 5.4325 1.0789 1.0831 H 1 UNK 0.0281 56 H24 4.8592 1.3701 2.7078 H 1 UNK 0.0281 57 H25 5.2794 2.7156 1.6753 H 1 UNK 0.0281 58 H26 1.5766 2.7420 1.6810 H 1 UNK 0.0281 59 H27 2.9946 3.7014 2.0300 H 1 UNK 0.0281 60 H28 2.5743 2.3558 3.0624 H 1 UNK 0.0281 61 H29 -5.1492 1.8787 0.1703 H 1 UNK 0.0656 62 H30 -5.0647 -1.8324 2.3894 H 1 UNK 0.0653 @BOND 1 1 20 1 2 2 11 1 3 2 21 1 4 3 13 1 5 3 21 1 6 4 16 1 7 5 22 2 8 6 26 1 9 7 31 2 10 8 9 1 11 8 11 1 12 8 15 1 13 8 19 1 14 9 10 1 15 9 14 1 16 10 12 1 17 10 18 1 18 11 13 1 19 11 22 1 20 12 16 1 21 12 17 1 22 13 14 1 23 15 16 1 24 17 23 1 25 17 24 1 26 17 25 1 27 18 20 1 28 20 23 1 29 21 27 1 30 21 28 1 31 22 26 1 32 23 29 2 33 25 30 2 34 29 31 1 35 30 31 1 36 4 32 1 37 6 33 1 38 9 34 1 39 10 35 1 40 12 36 1 41 13 37 1 42 14 38 1 43 14 39 1 44 15 40 1 45 15 41 1 46 16 42 1 47 18 43 1 48 18 44 1 49 19 45 1 50 19 46 1 51 19 47 1 52 20 48 1 53 24 49 1 54 24 50 1 55 24 51 1 56 25 52 1 57 26 53 1 58 26 54 1 59 27 55 1 60 27 56 1 61 27 57 1 62 28 58 1 63 28 59 1 64 28 60 1 65 29 61 1 66 30 62 1