@MOLECULE (7e)-4,7-dihydroxy-10-methyl-3,4,5,6,9,10-hexahydro-2h-oxecin-2-one 30 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.2061 -0.9760 -0.4320 O.3 1 UNL1111111111 -0.4624 2 O 3.3436 -1.2198 0.0105 O.3 1 UNL1111111111 -0.5496 3 O 1.1881 2.2946 0.8707 O.2 1 UNL1111111111 -0.4905 4 O -0.4322 -1.3821 1.6435 O.2 1 UNL1111111111 -0.5051 5 C 2.0749 -0.6034 0.0079 C.3 1 UNL1111111111 0.1857 6 C 2.0892 0.5491 -1.0081 C.3 1 UNL1111111111 -0.3174 7 C 0.7406 1.2549 -1.1704 C.3 1 UNL1111111111 -0.2970 8 C 1.0105 -1.6845 -0.2794 C.3 1 UNL1111111111 -0.4236 9 C -2.3849 -0.3285 0.0732 C.3 1 UNL1111111111 0.1654 10 C -2.2154 1.1699 -0.2433 C.3 1 UNL1111111111 -0.2829 11 C 0.1840 1.7574 0.1214 C.2 1 UNL1111111111 0.2865 12 C -1.0904 1.7479 0.5435 C.2 1 UNL1111111111 -0.3723 13 C -0.2503 -1.3442 0.4549 C.2 1 UNL1111111111 0.6249 14 C -3.5334 -0.9591 -0.7053 C.3 1 UNL1111111111 -0.4822 15 H 1.9969 -0.2259 1.0587 H 1 UNL1111111111 0.1689 16 H 2.4324 0.1813 -1.9936 H 1 UNL1111111111 0.1396 17 H 2.8555 1.2854 -0.6763 H 1 UNL1111111111 0.1738 18 H 0.0107 0.5713 -1.6596 H 1 UNL1111111111 0.1759 19 H 0.8589 2.1148 -1.8681 H 1 UNL1111111111 0.1632 20 H 1.3892 -2.6672 0.0867 H 1 UNL1111111111 0.1965 21 H 0.8349 -1.8012 -1.3652 H 1 UNL1111111111 0.1756 22 H -2.4784 -0.5055 1.1683 H 1 UNL1111111111 0.1522 23 H -3.1624 1.6997 -0.0153 H 1 UNL1111111111 0.1513 24 H -2.0605 1.3056 -1.3329 H 1 UNL1111111111 0.1506 25 H -1.3653 2.1504 1.5134 H 1 UNL1111111111 0.1615 26 H -3.6033 -2.0349 -0.4968 H 1 UNL1111111111 0.1611 27 H -4.4927 -0.5024 -0.4412 H 1 UNL1111111111 0.1542 28 H -3.3912 -0.8537 -1.7880 H 1 UNL1111111111 0.1585 29 H 3.5932 -1.5375 -0.8791 H 1 UNL1111111111 0.3101 30 H 0.8766 2.6097 1.7525 H 1 UNL1111111111 0.3277 @BOND 1 1 9 1 2 1 13 1 3 2 5 1 4 2 29 1 5 3 11 1 6 3 30 1 7 4 13 2 8 5 6 1 9 5 8 1 10 5 15 1 11 6 7 1 12 6 16 1 13 6 17 1 14 7 11 1 15 7 18 1 16 7 19 1 17 8 13 1 18 8 20 1 19 8 21 1 20 9 10 1 21 9 14 1 22 9 22 1 23 10 12 1 24 10 23 1 25 10 24 1 26 11 12 2 27 12 25 1 28 14 26 1 29 14 27 1 30 14 28 1