@MOLECULE 3-hydroxy-7-octenoic acid 25 24 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.7648 1.4993 1.0132 O.3 1 UNL1111111111 -0.5619 2 O 3.6284 -1.1730 -0.5115 O.3 1 UNL1111111111 -0.5574 3 O 2.2973 -0.7561 1.2244 O.2 1 UNL1111111111 -0.5339 4 C -0.2316 0.0218 -0.6218 C.3 1 UNL1111111111 -0.3432 5 C 0.7917 1.1311 -0.3389 C.3 1 UNL1111111111 0.1893 6 C -1.6458 0.5332 -0.3300 C.3 1 UNL1111111111 -0.2529 7 C 2.2237 0.6928 -0.7274 C.3 1 UNL1111111111 -0.4271 8 C -2.6768 -0.5923 -0.4956 C.3 1 UNL1111111111 -0.2905 9 C 2.6717 -0.4485 0.1191 C.2 1 UNL1111111111 0.6669 10 C -4.0541 -0.0878 -0.2034 C.2 1 UNL1111111111 -0.1072 11 C -4.9032 -0.7145 0.6102 C.2 1 UNL1111111111 -0.3410 12 H -0.0157 -0.8634 0.0093 H 1 UNL1111111111 0.1578 13 H -0.1534 -0.3199 -1.6689 H 1 UNL1111111111 0.1445 14 H 0.5234 2.0814 -0.8571 H 1 UNL1111111111 0.1447 15 H -1.6903 0.9380 0.7031 H 1 UNL1111111111 0.1616 16 H -1.8935 1.3816 -0.9940 H 1 UNL1111111111 0.1353 17 H 2.9220 1.5489 -0.5776 H 1 UNL1111111111 0.1969 18 H 2.2850 0.4481 -1.8074 H 1 UNL1111111111 0.1891 19 H -2.6425 -0.9941 -1.5297 H 1 UNL1111111111 0.1462 20 H -2.4117 -1.4450 0.1617 H 1 UNL1111111111 0.1493 21 H 1.0353 0.7442 1.5875 H 1 UNL1111111111 0.3463 22 H -4.3219 0.8372 -0.7131 H 1 UNL1111111111 0.1381 23 H -5.8997 -0.3587 0.8179 H 1 UNL1111111111 0.1439 24 H -4.6721 -1.6281 1.1344 H 1 UNL1111111111 0.1459 25 H 3.9724 -1.9325 0.0231 H 1 UNL1111111111 0.3592 @BOND 1 1 5 1 2 1 21 1 3 2 9 1 4 2 25 1 5 3 9 2 6 4 5 1 7 4 6 1 8 4 12 1 9 4 13 1 10 5 7 1 11 5 14 1 12 6 8 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 10 11 2 22 10 22 1 23 11 23 1 24 11 24 1