@MOLECULE (4as,8ar)-octahydro-3h-isochromen-3-one 25 26 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.9963 -1.0464 0.0689 O.3 1 UNL1111111111 -0.4120 2 O 3.3538 0.6433 0.0036 O.2 1 UNL1111111111 -0.4584 3 C -0.2916 0.6561 -0.3289 C.3 1 UNL1111111111 -0.0906 4 C -0.4334 -0.7466 0.2871 C.3 1 UNL1111111111 -0.1657 5 C -1.4572 1.5530 0.1177 C.3 1 UNL1111111111 -0.2778 6 C -1.7724 -1.3807 -0.1120 C.3 1 UNL1111111111 -0.2731 7 C -2.7963 0.9196 -0.2811 C.3 1 UNL1111111111 -0.2649 8 C -2.9363 -0.4824 0.3260 C.3 1 UNL1111111111 -0.2628 9 C 1.0463 1.2558 0.1110 C.3 1 UNL1111111111 -0.4059 10 C 0.7253 -1.6016 -0.2225 C.3 1 UNL1111111111 -0.0378 11 C 2.1994 0.2993 0.0284 C.2 1 UNL1111111111 0.6054 12 H -0.3118 0.5721 -1.4426 H 1 UNL1111111111 0.1435 13 H -0.3811 -0.6690 1.3992 H 1 UNL1111111111 0.1542 14 H -1.3620 2.5569 -0.3354 H 1 UNL1111111111 0.1377 15 H -1.4276 1.7073 1.2125 H 1 UNL1111111111 0.1412 16 H -1.8737 -2.3814 0.3475 H 1 UNL1111111111 0.1375 17 H -1.8137 -1.5396 -1.2061 H 1 UNL1111111111 0.1408 18 H -2.8775 0.8642 -1.3827 H 1 UNL1111111111 0.1379 19 H -3.6325 1.5618 0.0516 H 1 UNL1111111111 0.1331 20 H -2.9685 -0.4135 1.4295 H 1 UNL1111111111 0.1389 21 H -3.8981 -0.9339 0.0206 H 1 UNL1111111111 0.1331 22 H 0.9853 1.6184 1.1624 H 1 UNL1111111111 0.1822 23 H 1.2809 2.1628 -0.4880 H 1 UNL1111111111 0.1823 24 H 0.7825 -2.5855 0.2833 H 1 UNL1111111111 0.1486 25 H 0.6912 -1.7524 -1.3174 H 1 UNL1111111111 0.1326 @BOND 1 1 10 1 2 1 11 1 3 2 11 2 4 3 4 1 5 3 5 1 6 3 9 1 7 3 12 1 8 4 6 1 9 4 10 1 10 4 13 1 11 5 7 1 12 5 14 1 13 5 15 1 14 6 8 1 15 6 16 1 16 6 17 1 17 7 8 1 18 7 18 1 19 7 19 1 20 8 20 1 21 8 21 1 22 9 11 1 23 9 22 1 24 9 23 1 25 10 24 1 26 10 25 1