@MOLECULE (17beta)-2-fluoroestra-1(10),2,4-triene-3,4,17-triol 45 48 0 0 0 SMALL GASTEIGER @ATOM 1 F 4.0224 -2.5556 -0.1458 F 1 UNL1111111111 -0.1376 2 O -4.9431 -1.3952 0.6866 O.3 1 UNL1111111111 -0.5627 3 O 3.9695 2.0864 0.1963 O.3 1 UNL1111111111 -0.4873 4 O 5.3351 -0.2713 0.1478 O.3 1 UNL1111111111 -0.4123 5 C -3.1143 0.1370 0.5608 C.3 1 UNL1111111111 0.0593 6 C -2.4919 0.8717 -0.6563 C.3 1 UNL1111111111 -0.1444 7 C -0.9575 0.9247 -0.7052 C.3 1 UNL1111111111 -0.1131 8 C -0.3066 -0.4189 -0.3256 C.3 1 UNL1111111111 -0.1120 9 C -4.5502 -0.1970 0.0484 C.3 1 UNL1111111111 0.1298 10 C -2.3720 -1.1647 0.8933 C.3 1 UNL1111111111 -0.2769 11 C -3.0756 0.1520 -1.8948 C.3 1 UNL1111111111 -0.2747 12 C -0.8636 -0.9545 1.0064 C.3 1 UNL1111111111 -0.2677 13 C -4.4572 -0.3787 -1.4792 C.3 1 UNL1111111111 -0.3383 14 C -0.4101 2.0415 0.1963 C.3 1 UNL1111111111 -0.2704 15 C -3.2124 1.0361 1.7934 C.3 1 UNL1111111111 -0.4680 16 C 1.1899 -0.3026 -0.2168 C.ar 1 UNL1111111111 0.0202 17 C 1.0893 2.2285 -0.0636 C.3 1 UNL1111111111 -0.2652 18 C 1.8333 0.9308 -0.0711 C.ar 1 UNL1111111111 -0.1051 19 C 1.9300 -1.4904 -0.2479 C.ar 1 UNL1111111111 -0.2452 20 C 3.2276 0.9515 0.0464 C.ar 1 UNL1111111111 0.1413 21 C 3.3120 -1.4427 -0.1206 C.ar 1 UNL1111111111 0.1418 22 C 3.9864 -0.2268 0.0309 C.ar 1 UNL1111111111 0.1166 23 H -2.8721 1.9217 -0.6560 H 1 UNL1111111111 0.1343 24 H -0.6615 1.1611 -1.7600 H 1 UNL1111111111 0.1381 25 H -0.5553 -1.1575 -1.1320 H 1 UNL1111111111 0.1478 26 H -5.2780 0.5912 0.3274 H 1 UNL1111111111 0.1110 27 H -2.7761 -1.5925 1.8319 H 1 UNL1111111111 0.1536 28 H -2.5925 -1.9253 0.1175 H 1 UNL1111111111 0.1516 29 H -3.1410 0.8337 -2.7558 H 1 UNL1111111111 0.1339 30 H -2.4214 -0.6804 -2.2064 H 1 UNL1111111111 0.1433 31 H -0.3683 -1.9082 1.2709 H 1 UNL1111111111 0.1421 32 H -0.6241 -0.2574 1.8302 H 1 UNL1111111111 0.1434 33 H -5.2660 0.1573 -1.9970 H 1 UNL1111111111 0.1372 34 H -4.5667 -1.4440 -1.7460 H 1 UNL1111111111 0.1533 35 H -0.5823 1.7918 1.2608 H 1 UNL1111111111 0.1510 36 H -0.9471 2.9895 0.0152 H 1 UNL1111111111 0.1337 37 H -3.8376 0.5659 2.5643 H 1 UNL1111111111 0.1575 38 H -2.2283 1.2138 2.2411 H 1 UNL1111111111 0.1500 39 H -3.6499 2.0112 1.5592 H 1 UNL1111111111 0.1394 40 H 1.5003 2.9116 0.7102 H 1 UNL1111111111 0.1402 41 H 1.2320 2.7378 -1.0421 H 1 UNL1111111111 0.1480 42 H -5.8325 -1.6665 0.3956 H 1 UNL1111111111 0.3111 43 H 1.4232 -2.4477 -0.3688 H 1 UNL1111111111 0.1804 44 H 3.4343 2.9031 0.0519 H 1 UNL1111111111 0.3371 45 H 5.7010 0.6519 0.2332 H 1 UNL1111111111 0.3342 @BOND 1 1 21 1 2 2 9 1 3 2 42 1 4 3 20 1 5 3 44 1 6 4 22 1 7 4 45 1 8 5 6 1 9 5 9 1 10 5 10 1 11 5 15 1 12 6 7 1 13 6 11 1 14 6 23 1 15 7 8 1 16 7 14 1 17 7 24 1 18 8 12 1 19 8 16 1 20 8 25 1 21 9 13 1 22 9 26 1 23 10 12 1 24 10 27 1 25 10 28 1 26 11 13 1 27 11 29 1 28 11 30 1 29 12 31 1 30 12 32 1 31 13 33 1 32 13 34 1 33 14 17 1 34 14 35 1 35 14 36 1 36 15 37 1 37 15 38 1 38 15 39 1 39 16 18 ar 40 16 19 ar 41 17 18 1 42 17 40 1 43 17 41 1 44 18 20 ar 45 19 21 ar 46 19 43 1 47 20 22 ar 48 21 22 ar