@MOLECULE 1,9-nonanediol 31 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -6.1977 -0.3366 -0.0517 O.3 1 UNL111111111111 -0.5477 2 O 6.1982 -0.3342 -0.0636 O.3 1 UNL111111111111 -0.5477 3 C -0.0008 0.4854 -0.0037 C.3 1 UNL111111111111 -0.2741 4 C -1.2611 -0.3885 -0.0191 C.3 1 UNL111111111111 -0.2713 5 C 1.2604 -0.3871 -0.0141 C.3 1 UNL111111111111 -0.2715 6 C -2.5243 0.4818 0.0018 C.3 1 UNL111111111111 -0.2666 7 C 2.5249 0.4813 0.0061 C.3 1 UNL111111111111 -0.2666 8 C -3.7790 -0.3958 -0.0012 C.3 1 UNL111111111111 -0.3288 9 C 3.7791 -0.3972 0.0051 C.3 1 UNL111111111111 -0.3290 10 C -5.0405 0.4712 0.0267 C.3 1 UNL111111111111 0.0032 11 C 5.0403 0.4700 0.0362 C.3 1 UNL111111111111 0.0031 12 H -0.0027 1.1381 0.8892 H 1 UNL111111111111 0.1362 13 H 0.0006 1.1650 -0.8763 H 1 UNL111111111111 0.1381 14 H -1.2572 -1.0732 0.8496 H 1 UNL111111111111 0.1370 15 H -1.2617 -1.0363 -0.9160 H 1 UNL111111111111 0.1398 16 H 1.2626 -1.0378 -0.9091 H 1 UNL111111111111 0.1398 17 H 1.2550 -1.0695 0.8565 H 1 UNL111111111111 0.1370 18 H -2.5304 1.1588 -0.8737 H 1 UNL111111111111 0.1397 19 H -2.5172 1.1368 0.8934 H 1 UNL111111111111 0.1368 20 H 2.5179 1.1378 0.8966 H 1 UNL111111111111 0.1368 21 H 2.5322 1.1565 -0.8708 H 1 UNL111111111111 0.1397 22 H -3.7963 -1.0442 -0.8994 H 1 UNL111111111111 0.1558 23 H -3.7693 -1.0855 0.8626 H 1 UNL111111111111 0.1400 24 H 3.7986 -1.0436 -0.8945 H 1 UNL111111111111 0.1559 25 H 3.7667 -1.0871 0.8685 H 1 UNL111111111111 0.1399 26 H -5.1311 1.1116 -0.8706 H 1 UNL111111111111 0.1412 27 H -5.0988 1.0975 0.9336 H 1 UNL111111111111 0.1119 28 H 5.1059 1.0832 0.9517 H 1 UNL111111111111 0.1120 29 H 5.1229 1.1231 -0.8529 H 1 UNL111111111111 0.1413 30 H -6.2257 -0.9775 0.6834 H 1 UNL111111111111 0.3091 31 H 6.2307 -0.9896 0.6584 H 1 UNL111111111111 0.3091 @BOND 1 1 10 1 2 1 30 1 3 2 11 1 4 2 31 1 5 3 4 1 6 3 5 1 7 3 12 1 8 3 13 1 9 4 6 1 10 4 14 1 11 4 15 1 12 5 7 1 13 5 16 1 14 5 17 1 15 6 8 1 16 6 18 1 17 6 19 1 18 7 9 1 19 7 20 1 20 7 21 1 21 8 10 1 22 8 22 1 23 8 23 1 24 9 11 1 25 9 24 1 26 9 25 1 27 10 26 1 28 10 27 1 29 11 28 1 30 11 29 1