@MOLECULE (9cis,13cis)-4,4-difluororetinoic acid 50 50 0 0 0 SMALL GASTEIGER @ATOM 1 F -3.8410 2.5006 1.1783 F 1 UNL1111111111 -0.2291 2 F -3.0358 2.9249 -0.6962 F 1 UNL1111111111 -0.2333 3 O 7.3642 1.2680 0.4481 O.3 1 UNL1111111111 -0.5637 4 O 6.2491 -0.6507 0.4330 O.2 1 UNL1111111111 -0.5328 5 C -3.7811 -1.0752 -0.0398 C.3 1 UNL1111111111 0.0969 6 C -4.9712 -0.0951 0.0671 C.3 1 UNL1111111111 -0.2847 7 C -4.6726 1.2275 -0.6336 C.3 1 UNL1111111111 -0.3437 8 C -2.4759 -0.3879 0.2991 C.2 1 UNL1111111111 -0.0162 9 C -3.4600 1.8807 0.0437 C.3 1 UNL1111111111 0.4224 10 C -2.3117 0.9424 0.3383 C.2 1 UNL1111111111 -0.0999 11 C -4.0317 -2.2348 0.9393 C.3 1 UNL1111111111 -0.4617 12 C -3.6810 -1.6269 -1.4722 C.3 1 UNL1111111111 -0.4586 13 C -1.3497 -1.2879 0.5804 C.2 1 UNL1111111111 -0.1479 14 C -1.0162 1.5967 0.6688 C.3 1 UNL1111111111 -0.4319 15 C -0.5274 -1.7307 -0.3746 C.2 1 UNL1111111111 -0.1797 16 C 0.5931 -2.6370 -0.1009 C.2 1 UNL1111111111 0.0538 17 C 0.2143 -4.0728 0.0341 C.3 1 UNL1111111111 -0.4522 18 C 1.8640 -2.2110 -0.0054 C.2 1 UNL1111111111 -0.2261 19 C 2.2373 -0.8118 -0.1315 C.2 1 UNL1111111111 -0.0876 20 C 3.4977 -0.4222 -0.3870 C.2 1 UNL1111111111 -0.2279 21 C 3.9029 0.9742 -0.4994 C.2 1 UNL1111111111 0.1871 22 C 2.8674 1.9488 -0.9594 C.3 1 UNL1111111111 -0.4722 23 C 5.1480 1.4076 -0.2125 C.2 1 UNL1111111111 -0.3743 24 C 6.2265 0.5413 0.2390 C.2 1 UNL1111111111 0.6658 25 H -5.2117 0.0863 1.1342 H 1 UNL1111111111 0.1558 26 H -5.8785 -0.5584 -0.3638 H 1 UNL1111111111 0.1485 27 H -4.4640 1.0609 -1.7101 H 1 UNL1111111111 0.1683 28 H -5.5582 1.8939 -0.6073 H 1 UNL1111111111 0.1692 29 H -4.0132 -1.8907 1.9797 H 1 UNL1111111111 0.1521 30 H -5.0062 -2.7013 0.7598 H 1 UNL1111111111 0.1493 31 H -3.2737 -3.0195 0.8375 H 1 UNL1111111111 0.1508 32 H -4.6213 -2.0924 -1.7850 H 1 UNL1111111111 0.1495 33 H -3.4429 -0.8366 -2.1924 H 1 UNL1111111111 0.1499 34 H -2.8971 -2.3891 -1.5514 H 1 UNL1111111111 0.1512 35 H -1.2320 -1.5641 1.6309 H 1 UNL1111111111 0.1652 36 H -1.1475 2.4887 1.3018 H 1 UNL1111111111 0.1697 37 H -0.4943 1.9236 -0.2441 H 1 UNL1111111111 0.1602 38 H -0.3354 0.9281 1.2159 H 1 UNL1111111111 0.1571 39 H -0.6404 -1.4434 -1.4224 H 1 UNL1111111111 0.1645 40 H -0.2675 -4.4452 -0.8823 H 1 UNL1111111111 0.1601 41 H 1.0762 -4.7241 0.2345 H 1 UNL1111111111 0.1602 42 H -0.5020 -4.2194 0.8567 H 1 UNL1111111111 0.1604 43 H 2.6806 -2.9133 0.1732 H 1 UNL1111111111 0.1671 44 H 1.4278 -0.0885 -0.0008 H 1 UNL1111111111 0.1510 45 H 4.3008 -1.1613 -0.5042 H 1 UNL1111111111 0.1927 46 H 2.1421 2.1594 -0.1573 H 1 UNL1111111111 0.1703 47 H 3.2932 2.9149 -1.2650 H 1 UNL1111111111 0.1640 48 H 2.3008 1.5621 -1.8200 H 1 UNL1111111111 0.1686 49 H 5.4208 2.4623 -0.3040 H 1 UNL1111111111 0.1906 50 H 8.1228 0.7165 0.7559 H 1 UNL1111111111 0.3510 @BOND 1 1 9 1 2 2 9 1 3 3 24 1 4 3 50 1 5 4 24 2 6 5 6 1 7 5 8 1 8 5 11 1 9 5 12 1 10 6 7 1 11 6 25 1 12 6 26 1 13 7 9 1 14 7 27 1 15 7 28 1 16 8 10 2 17 8 13 1 18 9 10 1 19 10 14 1 20 11 29 1 21 11 30 1 22 11 31 1 23 12 32 1 24 12 33 1 25 12 34 1 26 13 15 2 27 13 35 1 28 14 36 1 29 14 37 1 30 14 38 1 31 15 16 1 32 15 39 1 33 16 17 1 34 16 18 2 35 17 40 1 36 17 41 1 37 17 42 1 38 18 19 1 39 18 43 1 40 19 20 2 41 19 44 1 42 20 21 1 43 20 45 1 44 21 22 1 45 21 23 2 46 22 46 1 47 22 47 1 48 22 48 1 49 23 24 1 50 23 49 1