@MOLECULE (2s)-1,1,2,3,3-pentamethyl-1,2,3,5,6,7-hexahydro-4h-inden-4-one 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.3960 -1.8235 -0.0875 O.2 1 UNL1111111111 -0.4702 2 C 1.3464 1.0697 0.1034 C.3 1 UNL1111111111 0.0576 3 C 1.7959 -0.4031 0.4181 C.3 1 UNL1111111111 -0.1325 4 C 0.5537 -1.3109 0.0827 C.3 1 UNL1111111111 0.1140 5 C -0.1651 0.9600 0.0870 C.2 1 UNL1111111111 0.0552 6 C -0.5846 -0.3180 0.0767 C.2 1 UNL1111111111 -0.2409 7 C -1.0737 2.1315 0.0834 C.3 1 UNL1111111111 -0.2959 8 C 1.8170 1.5733 -1.2634 C.3 1 UNL1111111111 -0.4501 9 C 1.8237 2.0200 1.2043 C.3 1 UNL1111111111 -0.4607 10 C 3.0873 -0.8301 -0.2619 C.3 1 UNL1111111111 -0.4411 11 C 0.3661 -2.3706 1.1712 C.3 1 UNL1111111111 -0.4653 12 C 0.6302 -1.9854 -1.2897 C.3 1 UNL1111111111 -0.4555 13 C -1.9981 -0.6897 0.0404 C.2 1 UNL1111111111 0.4964 14 C -2.4583 1.7370 -0.4600 C.3 1 UNL1111111111 -0.2448 15 C -2.9773 0.4586 0.2030 C.3 1 UNL1111111111 -0.3822 16 H 1.9592 -0.4683 1.5220 H 1 UNL1111111111 0.1402 17 H -1.1664 2.5276 1.1184 H 1 UNL1111111111 0.1610 18 H -0.6542 2.9654 -0.5148 H 1 UNL1111111111 0.1542 19 H 2.9089 1.6532 -1.3044 H 1 UNL1111111111 0.1511 20 H 1.5012 0.8961 -2.0663 H 1 UNL1111111111 0.1533 21 H 1.4080 2.5640 -1.4883 H 1 UNL1111111111 0.1420 22 H 1.4022 1.7515 2.1797 H 1 UNL1111111111 0.1486 23 H 2.9157 1.9932 1.2971 H 1 UNL1111111111 0.1512 24 H 1.5372 3.0560 0.9951 H 1 UNL1111111111 0.1453 25 H 3.9193 -0.1774 0.0263 H 1 UNL1111111111 0.1389 26 H 3.3564 -1.8549 0.0238 H 1 UNL1111111111 0.1459 27 H 3.0142 -0.8076 -1.3549 H 1 UNL1111111111 0.1494 28 H 1.2347 -3.0326 1.2361 H 1 UNL1111111111 0.1446 29 H 0.2060 -1.9186 2.1549 H 1 UNL1111111111 0.1422 30 H -0.5152 -2.9937 0.9563 H 1 UNL1111111111 0.1721 31 H 1.4317 -2.7285 -1.3304 H 1 UNL1111111111 0.1465 32 H -0.3143 -2.5055 -1.5091 H 1 UNL1111111111 0.1652 33 H 0.7952 -1.2568 -2.0888 H 1 UNL1111111111 0.1408 34 H -3.1760 2.5638 -0.3035 H 1 UNL1111111111 0.1400 35 H -2.3970 1.5896 -1.5565 H 1 UNL1111111111 0.1458 36 H -3.9627 0.1735 -0.2162 H 1 UNL1111111111 0.1702 37 H -3.1493 0.6183 1.2866 H 1 UNL1111111111 0.1674 @BOND 1 1 13 2 2 2 3 1 3 2 5 1 4 2 8 1 5 2 9 1 6 3 4 1 7 3 10 1 8 3 16 1 9 4 6 1 10 4 11 1 11 4 12 1 12 5 6 2 13 5 7 1 14 6 13 1 15 7 14 1 16 7 17 1 17 7 18 1 18 8 19 1 19 8 20 1 20 8 21 1 21 9 22 1 22 9 23 1 23 9 24 1 24 10 25 1 25 10 26 1 26 10 27 1 27 11 28 1 28 11 29 1 29 11 30 1 30 12 31 1 31 12 32 1 32 12 33 1 33 13 15 1 34 14 15 1 35 14 34 1 36 14 35 1 37 15 36 1 38 15 37 1