@MOLECULE 6-hydroxyoctanoic acid 27 26 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.7214 1.7056 0.4234 O.3 1 UNL1111111111 -0.5722 2 O 4.6190 0.4714 -0.4747 O.3 1 UNL1111111111 -0.5763 3 O 3.6843 -1.1902 0.6744 O.2 1 UNL1111111111 -0.5082 4 C -1.4543 -0.2497 0.3102 C.3 1 UNL1111111111 -0.2969 5 C -2.7454 0.4185 -0.1802 C.3 1 UNL1111111111 0.1584 6 C -0.2302 0.4691 -0.2683 C.3 1 UNL1111111111 -0.2646 7 C 1.0613 -0.2138 0.1917 C.3 1 UNL1111111111 -0.2564 8 C -4.0069 -0.3350 0.2740 C.3 1 UNL1111111111 -0.3204 9 C 2.2827 0.5130 -0.3771 C.3 1 UNL1111111111 -0.3458 10 C -4.2635 -1.5586 -0.5997 C.3 1 UNL1111111111 -0.4339 11 C 3.5373 -0.1909 0.0229 C.2 1 UNL1111111111 0.6471 12 H -1.4517 -1.3177 0.0281 H 1 UNL1111111111 0.1435 13 H -1.4222 -0.2158 1.4178 H 1 UNL1111111111 0.1580 14 H -2.7395 0.5644 -1.2827 H 1 UNL1111111111 0.1117 15 H -0.2455 1.5308 0.0537 H 1 UNL1111111111 0.1578 16 H -0.2840 0.4868 -1.3724 H 1 UNL1111111111 0.1334 17 H 1.0690 -1.2770 -0.1211 H 1 UNL1111111111 0.1513 18 H 1.1119 -0.2357 1.2990 H 1 UNL1111111111 0.1540 19 H -3.9083 -0.6287 1.3368 H 1 UNL1111111111 0.1533 20 H -4.8796 0.3448 0.2414 H 1 UNL1111111111 0.1403 21 H 2.2258 0.5793 -1.4859 H 1 UNL1111111111 0.1803 22 H 2.3123 1.5696 -0.0289 H 1 UNL1111111111 0.1837 23 H -3.4297 -2.2695 -0.5575 H 1 UNL1111111111 0.1461 24 H -4.4100 -1.2839 -1.6506 H 1 UNL1111111111 0.1431 25 H -5.1632 -2.0954 -0.2748 H 1 UNL1111111111 0.1465 26 H -3.5298 2.2058 0.2144 H 1 UNL1111111111 0.3108 27 H 5.4827 0.0528 -0.2446 H 1 UNL1111111111 0.3554 @BOND 1 1 5 1 2 1 26 1 3 2 11 1 4 2 27 1 5 3 11 2 6 4 5 1 7 4 6 1 8 4 12 1 9 4 13 1 10 5 8 1 11 5 14 1 12 6 7 1 13 6 15 1 14 6 16 1 15 7 9 1 16 7 17 1 17 7 18 1 18 8 10 1 19 8 19 1 20 8 20 1 21 9 11 1 22 9 21 1 23 9 22 1 24 10 23 1 25 10 24 1 26 10 25 1