@MOLECULE 1-(5,5-dimethyl-1-cyclohexen-1-yl)-4-penten-1-one 34 34 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.3207 -1.8918 -0.7017 O.2 1 UNL1111111111 -0.4614 2 C -2.5414 0.8642 -0.0852 C.3 1 UNL1111111111 0.1226 3 C -3.1163 -0.0836 0.9876 C.3 1 UNL1111111111 -0.2885 4 C -0.9949 0.8109 -0.0325 C.3 1 UNL1111111111 -0.2871 5 C -2.6674 -1.5338 0.7668 C.3 1 UNL1111111111 -0.2828 6 C -0.4753 -0.5855 0.0477 C.2 1 UNL1111111111 -0.1778 7 C -3.0323 0.4694 -1.4847 C.3 1 UNL1111111111 -0.4651 8 C -3.0039 2.2992 0.2198 C.3 1 UNL1111111111 -0.4755 9 C -1.2245 -1.6363 0.4125 C.2 1 UNL1111111111 -0.0652 10 C 0.9505 -0.8179 -0.2860 C.2 1 UNL1111111111 0.4638 11 C 1.9251 0.3116 -0.0600 C.3 1 UNL1111111111 -0.3696 12 C 3.3632 -0.1576 -0.3083 C.3 1 UNL1111111111 -0.2648 13 C 4.3273 0.9596 -0.0773 C.2 1 UNL1111111111 -0.1124 14 C 5.3756 0.8591 0.7394 C.2 1 UNL1111111111 -0.3392 15 H -4.2191 -0.0256 0.9923 H 1 UNL1111111111 0.1364 16 H -2.7890 0.2571 1.9883 H 1 UNL1111111111 0.1411 17 H -0.6369 1.3866 0.8473 H 1 UNL1111111111 0.1495 18 H -0.5877 1.3315 -0.9229 H 1 UNL1111111111 0.1474 19 H -3.2708 -1.9976 -0.0455 H 1 UNL1111111111 0.1578 20 H -2.8867 -2.1353 1.6734 H 1 UNL1111111111 0.1485 21 H -4.1227 0.3857 -1.5179 H 1 UNL1111111111 0.1427 22 H -2.7346 1.2074 -2.2367 H 1 UNL1111111111 0.1442 23 H -2.6145 -0.4962 -1.7943 H 1 UNL1111111111 0.1557 24 H -4.0939 2.3849 0.1561 H 1 UNL1111111111 0.1465 25 H -2.7085 2.6166 1.2247 H 1 UNL1111111111 0.1442 26 H -2.5798 3.0150 -0.4920 H 1 UNL1111111111 0.1472 27 H -0.8031 -2.6454 0.4495 H 1 UNL1111111111 0.1601 28 H 1.6767 1.1648 -0.7221 H 1 UNL1111111111 0.1646 29 H 1.8218 0.6932 0.9764 H 1 UNL1111111111 0.1677 30 H 3.5859 -1.0386 0.3299 H 1 UNL1111111111 0.1596 31 H 3.4635 -0.5398 -1.3486 H 1 UNL1111111111 0.1648 32 H 4.1185 1.8709 -0.6363 H 1 UNL1111111111 0.1368 33 H 6.0816 1.6570 0.9033 H 1 UNL1111111111 0.1415 34 H 5.6132 -0.0271 1.3065 H 1 UNL1111111111 0.1468 @BOND 1 1 10 2 2 2 3 1 3 2 4 1 4 2 7 1 5 2 8 1 6 3 5 1 7 3 15 1 8 3 16 1 9 4 6 1 10 4 17 1 11 4 18 1 12 5 9 1 13 5 19 1 14 5 20 1 15 6 9 2 16 6 10 1 17 7 21 1 18 7 22 1 19 7 23 1 20 8 24 1 21 8 25 1 22 8 26 1 23 9 27 1 24 10 11 1 25 11 12 1 26 11 28 1 27 11 29 1 28 12 13 1 29 12 30 1 30 12 31 1 31 13 14 2 32 13 32 1 33 14 33 1 34 14 34 1