@MOLECULE 5-fluoro-12-hydroxy-5,8,10,14-icosatetraenoic acid 55 54 0 0 0 SMALL GASTEIGER @ATOM 1 F -4.1200 -2.4024 0.0522 F 1 UNL1111111111 -0.1989 2 O 4.4432 -1.4413 0.0538 O.3 1 UNL1111111111 -0.5676 3 O 0.7623 0.5200 2.5054 O.3 1 UNL1111111111 -0.5699 4 O 1.0002 -1.6159 1.9244 O.2 1 UNL1111111111 -0.5297 5 C 0.0767 2.6136 0.3020 C.3 1 UNL1111111111 -0.2699 6 C -1.0233 3.1527 -0.6184 C.3 1 UNL1111111111 -0.2768 7 C 1.4599 2.7783 -0.3463 C.3 1 UNL1111111111 -0.2765 8 C -2.4050 2.9757 0.0252 C.3 1 UNL1111111111 -0.2506 9 C 2.5265 2.3317 0.5994 C.2 1 UNL1111111111 -0.1884 10 C 3.4779 0.4921 -0.8335 C.3 1 UNL1111111111 -0.3032 11 C -3.5161 3.3598 -0.9511 C.3 1 UNL1111111111 -0.4398 12 C 3.3986 1.3411 0.3890 C.2 1 UNL1111111111 -0.1601 13 C 3.2043 -0.9802 -0.4701 C.3 1 UNL1111111111 0.1485 14 C -2.0934 -0.7209 1.8049 C.3 1 UNL1111111111 -0.2405 15 C -1.9474 -1.8369 0.7612 C.3 1 UNL1111111111 -0.3155 16 C 2.8353 -1.7860 -1.6782 C.2 1 UNL1111111111 -0.2056 17 C -1.0791 -0.8709 2.9443 C.3 1 UNL1111111111 -0.3429 18 C -3.0204 -1.7220 -0.2667 C.2 1 UNL1111111111 0.1892 19 C -1.8600 -0.2166 -1.8725 C.3 1 UNL1111111111 -0.2761 20 C -3.0178 -1.0455 -1.4211 C.2 1 UNL1111111111 -0.2523 21 C 1.6296 -1.7694 -2.2615 C.2 1 UNL1111111111 -0.1561 22 C -0.7207 -1.0784 -2.3168 C.2 1 UNL1111111111 -0.1204 23 C 0.5153 -0.9456 -1.8165 C.2 1 UNL1111111111 -0.1923 24 C 0.3122 -0.7528 2.4058 C.2 1 UNL1111111111 0.6564 25 H -0.1050 1.5466 0.5327 H 1 UNL1111111111 0.1404 26 H 0.0469 3.1347 1.2777 H 1 UNL1111111111 0.1441 27 H -0.8469 4.2225 -0.8371 H 1 UNL1111111111 0.1382 28 H -0.9882 2.6401 -1.5978 H 1 UNL1111111111 0.1372 29 H 1.6279 3.8419 -0.6184 H 1 UNL1111111111 0.1493 30 H 1.4925 2.2255 -1.3062 H 1 UNL1111111111 0.1448 31 H -2.5452 1.9292 0.3574 H 1 UNL1111111111 0.1302 32 H -2.4742 3.5920 0.9415 H 1 UNL1111111111 0.1351 33 H 2.5589 2.9107 1.5252 H 1 UNL1111111111 0.1447 34 H 2.7855 0.8219 -1.6318 H 1 UNL1111111111 0.1555 35 H 4.4983 0.5655 -1.2761 H 1 UNL1111111111 0.1752 36 H -3.4078 4.3940 -1.2959 H 1 UNL1111111111 0.1423 37 H -3.5131 2.7145 -1.8367 H 1 UNL1111111111 0.1422 38 H -4.5035 3.2707 -0.4844 H 1 UNL1111111111 0.1418 39 H 4.1532 1.0863 1.1397 H 1 UNL1111111111 0.1569 40 H 2.4377 -1.0735 0.3363 H 1 UNL1111111111 0.1478 41 H -3.1196 -0.7300 2.2264 H 1 UNL1111111111 0.1555 42 H -1.9801 0.2713 1.3209 H 1 UNL1111111111 0.1506 43 H -1.9615 -2.8328 1.2554 H 1 UNL1111111111 0.1721 44 H -0.9438 -1.7906 0.2742 H 1 UNL1111111111 0.1860 45 H -1.2650 -0.0991 3.7227 H 1 UNL1111111111 0.1794 46 H -1.1984 -1.8550 3.4473 H 1 UNL1111111111 0.1790 47 H 3.6448 -2.4103 -2.0589 H 1 UNL1111111111 0.1619 48 H -2.1627 0.4500 -2.7122 H 1 UNL1111111111 0.1579 49 H -1.5495 0.4820 -1.0618 H 1 UNL1111111111 0.1614 50 H -3.8733 -1.0595 -2.0953 H 1 UNL1111111111 0.1679 51 H 1.4323 -2.4010 -3.1320 H 1 UNL1111111111 0.1507 52 H 4.3410 -2.3318 0.4405 H 1 UNL1111111111 0.3179 53 H -0.9709 -1.8185 -3.0747 H 1 UNL1111111111 0.1519 54 H 0.7366 -0.2014 -1.0488 H 1 UNL1111111111 0.1540 55 H 1.6608 0.6673 2.0962 H 1 UNL1111111111 0.3666 @BOND 1 1 18 1 2 2 13 1 3 2 52 1 4 3 24 1 5 3 55 1 6 4 24 2 7 5 6 1 8 5 7 1 9 5 25 1 10 5 26 1 11 6 8 1 12 6 27 1 13 6 28 1 14 7 9 1 15 7 29 1 16 7 30 1 17 8 11 1 18 8 31 1 19 8 32 1 20 9 12 2 21 9 33 1 22 10 12 1 23 10 13 1 24 10 34 1 25 10 35 1 26 11 36 1 27 11 37 1 28 11 38 1 29 12 39 1 30 13 16 1 31 13 40 1 32 14 15 1 33 14 17 1 34 14 41 1 35 14 42 1 36 15 18 1 37 15 43 1 38 15 44 1 39 16 21 2 40 16 47 1 41 17 24 1 42 17 45 1 43 17 46 1 44 18 20 2 45 19 20 1 46 19 22 1 47 19 48 1 48 19 49 1 49 20 50 1 50 21 23 1 51 21 51 1 52 22 23 2 53 22 53 1 54 23 54 1