@MOLECULE 4,4-difluororetinol 51 51 0 0 0 SMALL GASTEIGER @ATOM 1 F -5.2984 1.7611 1.0208 F 1 UNL1111111111 -0.2300 2 F -4.5927 2.5393 -0.7779 F 1 UNL1111111111 -0.2319 3 O 8.7384 1.9887 0.1749 O.3 1 UNL1111111111 -0.5446 4 C -3.6674 -1.4318 -0.1886 C.3 1 UNL1111111111 0.0985 5 C -5.1604 -1.0348 -0.1837 C.3 1 UNL1111111111 -0.2852 6 C -5.3832 0.3190 -0.8523 C.3 1 UNL1111111111 -0.3428 7 C -2.7975 -0.2810 0.2719 C.2 1 UNL1111111111 -0.0212 8 C -4.6053 1.3899 -0.0742 C.3 1 UNL1111111111 0.4221 9 C -3.2001 0.9972 0.3218 C.2 1 UNL1111111111 -0.0963 10 C -3.4936 -2.6348 0.7551 C.3 1 UNL1111111111 -0.4619 11 C -3.2303 -1.8295 -1.6089 C.3 1 UNL1111111111 -0.4585 12 C -1.4311 -0.6566 0.6585 C.2 1 UNL1111111111 -0.1440 13 C -2.3196 2.1138 0.7583 C.3 1 UNL1111111111 -0.4336 14 C -0.4115 -0.6597 -0.2075 C.2 1 UNL1111111111 -0.1765 15 C 0.9574 -1.0274 0.1614 C.2 1 UNL1111111111 0.0460 16 C 1.1195 -2.2225 1.0396 C.3 1 UNL1111111111 -0.4528 17 C 1.9885 -0.2906 -0.2952 C.2 1 UNL1111111111 -0.2168 18 C 3.3818 -0.5509 0.0174 C.2 1 UNL1111111111 -0.1327 19 C 4.3850 0.0794 -0.6167 C.2 1 UNL1111111111 -0.1782 20 C 5.7967 -0.1558 -0.3149 C.2 1 UNL1111111111 0.0275 21 C 6.2141 -1.5670 -0.0607 C.3 1 UNL1111111111 -0.4520 22 C 6.6568 0.8731 -0.2695 C.2 1 UNL1111111111 -0.2590 23 C 8.1084 0.7289 0.0381 C.3 1 UNL1111111111 0.0058 24 H -5.5366 -1.0091 0.8589 H 1 UNL1111111111 0.1548 25 H -5.7574 -1.8142 -0.6934 H 1 UNL1111111111 0.1475 26 H -5.0429 0.2937 -1.9077 H 1 UNL1111111111 0.1684 27 H -6.4645 0.5594 -0.8995 H 1 UNL1111111111 0.1681 28 H -3.6998 -2.3591 1.7954 H 1 UNL1111111111 0.1508 29 H -4.1725 -3.4507 0.4852 H 1 UNL1111111111 0.1486 30 H -2.4746 -3.0356 0.7145 H 1 UNL1111111111 0.1500 31 H -2.1945 -2.1896 -1.6203 H 1 UNL1111111111 0.1528 32 H -3.8596 -2.6309 -2.0087 H 1 UNL1111111111 0.1483 33 H -3.2879 -0.9814 -2.2999 H 1 UNL1111111111 0.1504 34 H -1.3122 -0.9282 1.7092 H 1 UNL1111111111 0.1616 35 H -1.4426 1.7650 1.3232 H 1 UNL1111111111 0.1593 36 H -2.8439 2.8329 1.4063 H 1 UNL1111111111 0.1672 37 H -1.9371 2.6798 -0.1065 H 1 UNL1111111111 0.1661 38 H -0.5516 -0.3622 -1.2497 H 1 UNL1111111111 0.1616 39 H 1.9416 -2.8701 0.7028 H 1 UNL1111111111 0.1591 40 H 1.3406 -1.9231 2.0753 H 1 UNL1111111111 0.1619 41 H 0.2175 -2.8491 1.0665 H 1 UNL1111111111 0.1551 42 H 1.8017 0.5701 -0.9434 H 1 UNL1111111111 0.1581 43 H 3.5821 -1.2819 0.8022 H 1 UNL1111111111 0.1490 44 H 4.1905 0.8208 -1.3945 H 1 UNL1111111111 0.1571 45 H 6.2895 -1.7675 1.0180 H 1 UNL1111111111 0.1578 46 H 7.1915 -1.7968 -0.5072 H 1 UNL1111111111 0.1559 47 H 5.5012 -2.2920 -0.4784 H 1 UNL1111111111 0.1584 48 H 6.3375 1.8953 -0.4709 H 1 UNL1111111111 0.1653 49 H 8.6685 0.2718 -0.8056 H 1 UNL1111111111 0.1513 50 H 8.2954 0.1420 0.9585 H 1 UNL1111111111 0.1223 51 H 8.2960 2.5235 0.8624 H 1 UNL1111111111 0.3112 @BOND 1 1 8 1 2 2 8 1 3 3 23 1 4 3 51 1 5 4 5 1 6 4 7 1 7 4 10 1 8 4 11 1 9 5 6 1 10 5 24 1 11 5 25 1 12 6 8 1 13 6 26 1 14 6 27 1 15 7 9 2 16 7 12 1 17 8 9 1 18 9 13 1 19 10 28 1 20 10 29 1 21 10 30 1 22 11 31 1 23 11 32 1 24 11 33 1 25 12 14 2 26 12 34 1 27 13 35 1 28 13 36 1 29 13 37 1 30 14 15 1 31 14 38 1 32 15 16 1 33 15 17 2 34 16 39 1 35 16 40 1 36 16 41 1 37 17 18 1 38 17 42 1 39 18 19 2 40 18 43 1 41 19 20 1 42 19 44 1 43 20 21 1 44 20 22 2 45 21 45 1 46 21 46 1 47 21 47 1 48 22 23 1 49 22 48 1 50 23 49 1 51 23 50 1