@MOLECULE (2s)-2,3-dihydroxypropyl (5z,8z,11z,14z)-5,8,11,14-icosatetraenoate 65 64 0 0 0 SMALL GASTEIGER @ATOM 1 C -4.9441 0.0574 -0.9003 C.2 1 UNL1111111111 0.6119 2 O -6.1904 0.1973 -0.3708 O.3 1 UNL1111111111 -0.4350 3 C -4.1228 -0.8183 -0.0050 C.3 1 UNL1111111111 -0.3481 4 C -3.2975 -1.7869 -0.8575 C.3 1 UNL1111111111 -0.2510 5 O -4.6225 0.5865 -1.9309 O.2 1 UNL1111111111 -0.5049 6 C -2.3538 -2.6175 0.0235 C.3 1 UNL1111111111 -0.2737 7 C -1.6006 -3.5919 -0.8232 C.2 1 UNL1111111111 -0.1631 8 C -0.2724 -3.6357 -0.9597 C.2 1 UNL1111111111 -0.1602 9 C 0.6949 -2.7089 -0.2924 C.3 1 UNL1111111111 -0.2810 10 C 1.1094 -3.2333 1.0460 C.2 1 UNL1111111111 -0.1678 11 C 1.9447 -2.5894 1.8682 C.2 1 UNL1111111111 -0.1669 12 C 2.5710 -1.2715 1.5459 C.3 1 UNL1111111111 -0.2756 13 C 3.2634 -0.6447 2.7128 C.2 1 UNL1111111111 -0.1732 14 C 4.0550 0.4286 2.6142 C.2 1 UNL1111111111 -0.1590 15 C 4.3516 1.1255 1.3243 C.3 1 UNL1111111111 -0.2783 16 C 5.2291 2.3167 1.5446 C.2 1 UNL1111111111 -0.1745 17 C 6.5233 2.4012 1.2235 C.2 1 UNL1111111111 -0.1544 18 C 7.3378 1.3170 0.5989 C.3 1 UNL1111111111 -0.2781 19 C 8.2105 1.8796 -0.5339 C.3 1 UNL1111111111 -0.2683 20 C 9.0242 0.7619 -1.1970 C.3 1 UNL1111111111 -0.2724 21 C 9.9316 1.3300 -2.2966 C.3 1 UNL1111111111 -0.2502 22 C 10.7596 0.2217 -2.9471 C.3 1 UNL1111111111 -0.4403 23 C -7.1089 1.0318 -1.0767 C.3 1 UNL1111111111 -0.0819 24 C -8.0345 1.5932 0.0079 C.3 1 UNL1111111111 0.0753 25 C -9.5125 1.2687 -0.2603 C.3 1 UNL1111111111 -0.0592 26 O -7.8935 2.9918 0.1221 O.3 1 UNL1111111111 -0.5481 27 O -10.3136 1.7672 0.7877 O.3 1 UNL1111111111 -0.5330 28 H -3.4593 -0.1757 0.6153 H 1 UNL1111111111 0.1810 29 H -4.7617 -1.3717 0.7161 H 1 UNL1111111111 0.1791 30 H -3.9660 -2.4530 -1.4365 H 1 UNL1111111111 0.1450 31 H -2.7106 -1.2254 -1.6149 H 1 UNL1111111111 0.1631 32 H -1.6727 -1.9504 0.5893 H 1 UNL1111111111 0.1509 33 H -2.9299 -3.1675 0.7970 H 1 UNL1111111111 0.1477 34 H -2.2357 -4.3065 -1.3493 H 1 UNL1111111111 0.1424 35 H 0.1976 -4.3941 -1.5867 H 1 UNL1111111111 0.1428 36 H 1.5928 -2.5658 -0.9357 H 1 UNL1111111111 0.1545 37 H 0.2599 -1.6889 -0.1876 H 1 UNL1111111111 0.1575 38 H 0.6814 -4.1965 1.3199 H 1 UNL1111111111 0.1501 39 H 2.2220 -3.0187 2.8303 H 1 UNL1111111111 0.1483 40 H 3.2885 -1.4067 0.7017 H 1 UNL1111111111 0.1594 41 H 1.8012 -0.5641 1.1560 H 1 UNL1111111111 0.1580 42 H 3.0773 -1.1143 3.6773 H 1 UNL1111111111 0.1472 43 H 4.5378 0.8536 3.4934 H 1 UNL1111111111 0.1503 44 H 4.8097 0.4090 0.6055 H 1 UNL1111111111 0.1548 45 H 3.4027 1.4471 0.8369 H 1 UNL1111111111 0.1545 46 H 4.7186 3.1570 2.0170 H 1 UNL1111111111 0.1431 47 H 7.0819 3.3175 1.4248 H 1 UNL1111111111 0.1423 48 H 7.9776 0.8456 1.3755 H 1 UNL1111111111 0.1501 49 H 6.7036 0.4956 0.2089 H 1 UNL1111111111 0.1449 50 H 7.5714 2.3818 -1.2848 H 1 UNL1111111111 0.1401 51 H 8.8878 2.6605 -0.1403 H 1 UNL1111111111 0.1368 52 H 9.6345 0.2358 -0.4393 H 1 UNL1111111111 0.1372 53 H 8.3471 -0.0015 -1.6232 H 1 UNL1111111111 0.1367 54 H 9.3223 1.8459 -3.0624 H 1 UNL1111111111 0.1340 55 H 10.6016 2.1021 -1.8728 H 1 UNL1111111111 0.1336 56 H 11.4304 0.6242 -3.7137 H 1 UNL1111111111 0.1402 57 H 11.3797 -0.3001 -2.2098 H 1 UNL1111111111 0.1424 58 H 10.1201 -0.5262 -3.4285 H 1 UNL1111111111 0.1423 59 H -6.5711 1.8378 -1.6148 H 1 UNL1111111111 0.1627 60 H -7.6172 0.3843 -1.8112 H 1 UNL1111111111 0.1401 61 H -7.7216 1.2460 1.0261 H 1 UNL1111111111 0.1819 62 H -9.8749 1.7053 -1.2080 H 1 UNL1111111111 0.1220 63 H -8.0787 3.4486 -0.7221 H 1 UNL1111111111 0.3141 64 H -9.9772 2.6476 1.0749 H 1 UNL1111111111 0.3280 65 H -9.7121 0.1805 -0.2520 H 1 UNL1111111111 0.1517 @BOND 1 1 2 1 2 1 3 1 3 1 5 2 4 2 23 1 5 3 4 1 6 3 28 1 7 3 29 1 8 4 6 1 9 4 30 1 10 4 31 1 11 6 7 1 12 6 32 1 13 6 33 1 14 7 8 2 15 7 34 1 16 8 9 1 17 8 35 1 18 9 10 1 19 9 36 1 20 9 37 1 21 10 11 2 22 10 38 1 23 11 12 1 24 11 39 1 25 12 13 1 26 12 40 1 27 12 41 1 28 13 14 2 29 13 42 1 30 14 15 1 31 14 43 1 32 15 16 1 33 15 44 1 34 15 45 1 35 16 17 2 36 16 46 1 37 17 18 1 38 17 47 1 39 18 19 1 40 18 48 1 41 18 49 1 42 19 20 1 43 19 50 1 44 19 51 1 45 20 21 1 46 20 52 1 47 20 53 1 48 21 22 1 49 21 54 1 50 21 55 1 51 22 56 1 52 22 57 1 53 22 58 1 54 23 24 1 55 23 59 1 56 23 60 1 57 24 25 1 58 24 26 1 59 24 61 1 60 25 27 1 61 25 62 1 62 25 65 1 63 26 63 1 64 27 64 1