@MOLECULE (1r,5s,7r)-7-ethyl-5-methyl-6,8-dioxabicyclo[3.2.1]oct-2-ene 25 26 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.4551 -0.5971 0.7071 O.3 1 UNL1111111111 -0.4601 2 O 0.6426 -0.1660 -1.2332 O.3 1 UNL1111111111 -0.4162 3 C 0.7270 -0.9219 -0.0281 C.3 1 UNL1111111111 0.4700 4 C -0.9591 0.6530 0.2232 C.3 1 UNL1111111111 0.0899 5 C 0.1350 1.1003 -0.7967 C.3 1 UNL1111111111 0.0608 6 C 1.9444 -0.4209 0.7815 C.3 1 UNL1111111111 -0.3648 7 C -2.3123 0.4053 -0.4391 C.3 1 UNL1111111111 -0.2945 8 C 1.2409 1.8033 -0.0664 C.2 1 UNL1111111111 -0.2462 9 C 0.7090 -2.3932 -0.3727 C.3 1 UNL1111111111 -0.4902 10 C 2.0883 1.0659 0.6616 C.2 1 UNL1111111111 -0.0894 11 C -3.3282 -0.0793 0.5927 C.3 1 UNL1111111111 -0.4290 12 H -1.0290 1.3069 1.1121 H 1 UNL1111111111 0.1406 13 H -0.2289 1.6029 -1.7040 H 1 UNL1111111111 0.1528 14 H 2.8651 -0.9235 0.4265 H 1 UNL1111111111 0.1642 15 H 1.8151 -0.7111 1.8444 H 1 UNL1111111111 0.1713 16 H -2.1953 -0.3538 -1.2397 H 1 UNL1111111111 0.1575 17 H -2.6712 1.3270 -0.9325 H 1 UNL1111111111 0.1392 18 H 1.3063 2.8767 -0.1730 H 1 UNL1111111111 0.1547 19 H 1.5387 -2.6557 -1.0407 H 1 UNL1111111111 0.1666 20 H 0.7692 -3.0135 0.5296 H 1 UNL1111111111 0.1658 21 H -0.2263 -2.6557 -0.8897 H 1 UNL1111111111 0.1752 22 H 2.9261 1.4977 1.2031 H 1 UNL1111111111 0.1433 23 H -2.9512 -0.9674 1.1200 H 1 UNL1111111111 0.1584 24 H -3.5360 0.6850 1.3489 H 1 UNL1111111111 0.1399 25 H -4.2781 -0.3526 0.1218 H 1 UNL1111111111 0.1403 @BOND 1 1 3 1 2 1 4 1 3 2 3 1 4 2 5 1 5 3 6 1 6 3 9 1 7 4 5 1 8 4 7 1 9 4 12 1 10 5 8 1 11 5 13 1 12 6 10 1 13 6 14 1 14 6 15 1 15 7 11 1 16 7 16 1 17 7 17 1 18 8 10 2 19 8 18 1 20 9 19 1 21 9 20 1 22 9 21 1 23 10 22 1 24 11 23 1 25 11 24 1 26 11 25 1