@MOLECULE 6-methyl-2-(4-methylphenyl)-5-hepten-2-ol 38 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.1019 2.6455 1.0800 O.3 1 UNL1111111111 -0.5710 2 C -0.0336 2.0213 -0.1940 C.3 1 UNL1111111111 0.3213 3 C 1.4136 1.5559 -0.4554 C.3 1 UNL1111111111 -0.3307 4 C -0.9756 0.8412 -0.1199 C.ar 1 UNL1111111111 -0.0581 5 C 1.9732 0.7905 0.7555 C.3 1 UNL1111111111 -0.2530 6 C -0.4942 3.0400 -1.2442 C.3 1 UNL1111111111 -0.5010 7 C -1.1971 0.0597 -1.2558 C.ar 1 UNL1111111111 -0.1547 8 C -1.6003 0.5049 1.0810 C.ar 1 UNL1111111111 -0.1153 9 C 3.0153 -0.1811 0.3084 C.2 1 UNL1111111111 -0.2441 10 C -2.0284 -1.0543 -1.1888 C.ar 1 UNL1111111111 -0.1916 11 C -2.4328 -0.6092 1.1485 C.ar 1 UNL1111111111 -0.1941 12 C -2.6475 -1.3968 0.0157 C.ar 1 UNL1111111111 0.0455 13 C 2.7767 -1.4759 0.0586 C.2 1 UNL1111111111 0.0639 14 C -3.5157 -2.6066 0.0955 C.3 1 UNL1111111111 -0.4548 15 C 3.8669 -2.3915 -0.3985 C.3 1 UNL1111111111 -0.4582 16 C 1.4363 -2.1126 0.2135 C.3 1 UNL1111111111 -0.4653 17 H 1.4372 0.9097 -1.3539 H 1 UNL1111111111 0.1570 18 H 2.0624 2.4164 -0.6916 H 1 UNL1111111111 0.1408 19 H 1.1489 0.2773 1.2963 H 1 UNL1111111111 0.1603 20 H 2.3892 1.4997 1.4972 H 1 UNL1111111111 0.1391 21 H 0.1347 3.9352 -1.2409 H 1 UNL1111111111 0.1490 22 H -0.4790 2.6199 -2.2541 H 1 UNL1111111111 0.1548 23 H -1.5229 3.3627 -1.0327 H 1 UNL1111111111 0.1675 24 H -0.7176 0.3150 -2.1988 H 1 UNL1111111111 0.1489 25 H -1.4373 1.1164 1.9718 H 1 UNL1111111111 0.1751 26 H 4.0067 0.2454 0.1830 H 1 UNL1111111111 0.1429 27 H 0.5628 3.3537 1.1540 H 1 UNL1111111111 0.3182 28 H -2.1938 -1.6590 -2.0769 H 1 UNL1111111111 0.1514 29 H -2.9154 -0.8646 2.0889 H 1 UNL1111111111 0.1531 30 H -4.0018 -2.8370 -0.8618 H 1 UNL1111111111 0.1534 31 H -2.9248 -3.4907 0.3807 H 1 UNL1111111111 0.1602 32 H -4.3152 -2.4976 0.8409 H 1 UNL1111111111 0.1551 33 H 3.9402 -3.2761 0.2494 H 1 UNL1111111111 0.1545 34 H 3.6766 -2.7479 -1.4207 H 1 UNL1111111111 0.1541 35 H 4.8532 -1.9108 -0.4017 H 1 UNL1111111111 0.1485 36 H 1.1914 -2.2611 1.2756 H 1 UNL1111111111 0.1593 37 H 1.3688 -3.0904 -0.2768 H 1 UNL1111111111 0.1485 38 H 0.6339 -1.4860 -0.2108 H 1 UNL1111111111 0.1694 @BOND 1 1 2 1 2 1 27 1 3 2 3 1 4 2 4 1 5 2 6 1 6 3 5 1 7 3 17 1 8 3 18 1 9 4 7 ar 10 4 8 ar 11 5 9 1 12 5 19 1 13 5 20 1 14 6 21 1 15 6 22 1 16 6 23 1 17 7 10 ar 18 7 24 1 19 8 11 ar 20 8 25 1 21 9 13 2 22 9 26 1 23 10 12 ar 24 10 28 1 25 11 12 ar 26 11 29 1 27 12 14 1 28 13 15 1 29 13 16 1 30 14 30 1 31 14 31 1 32 14 32 1 33 15 33 1 34 15 34 1 35 15 35 1 36 16 36 1 37 16 37 1 38 16 38 1