@MOLECULE (2e)-2-{(2r,4s)-4-hydroxy-2-[(1r,2s)-2-hydroxy-4,4-dimethylcyclopentyl]-2-methylcyclobutylidene}propanal 42 43 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.2919 -2.1229 -0.9774 O.3 1 UNL1111111111 -0.5715 2 O 2.6568 2.5136 -0.6774 O.3 1 UNL1111111111 -0.5335 3 O 3.2093 -2.4375 0.5736 O.2 1 UNL1111111111 -0.4176 4 C 0.5094 -0.0042 -0.9718 C.3 1 UNL1111111111 0.0555 5 C -0.7729 -0.4063 -0.2371 C.3 1 UNL1111111111 -0.1853 6 C -1.2972 0.6335 0.7635 C.3 1 UNL1111111111 -0.3024 7 C -2.8396 0.4690 0.7885 C.3 1 UNL1111111111 0.1227 8 C -1.9673 -0.7498 -1.1585 C.3 1 UNL1111111111 0.1641 9 C 0.5335 1.4569 -1.5405 C.3 1 UNL1111111111 -0.3641 10 C -3.1931 0.0163 -0.6452 C.3 1 UNL1111111111 -0.3307 11 C 1.5890 0.4034 0.0297 C.2 1 UNL1111111111 -0.1311 12 C 1.4684 1.8716 -0.3559 C.3 1 UNL1111111111 0.1624 13 C 0.9675 -1.0590 -1.9608 C.3 1 UNL1111111111 -0.4618 14 C -3.2438 -0.6085 1.8002 C.3 1 UNL1111111111 -0.4678 15 C -3.5236 1.7920 1.1389 C.3 1 UNL1111111111 -0.4727 16 C 2.3970 -0.2396 0.8589 C.2 1 UNL1111111111 -0.0945 17 C 3.4218 0.4273 1.7037 C.3 1 UNL1111111111 -0.4394 18 C 2.3454 -1.7164 1.0074 C.2 1 UNL1111111111 0.3372 19 H -0.5340 -1.3391 0.3435 H 1 UNL1111111111 0.1546 20 H -0.8583 0.4985 1.7628 H 1 UNL1111111111 0.1421 21 H -1.0421 1.6614 0.4578 H 1 UNL1111111111 0.1430 22 H -1.7674 -0.5734 -2.2315 H 1 UNL1111111111 0.1134 23 H -0.4303 1.9637 -1.5722 H 1 UNL1111111111 0.1556 24 H 0.9935 1.5497 -2.5255 H 1 UNL1111111111 0.1570 25 H -3.4108 0.8820 -1.2934 H 1 UNL1111111111 0.1427 26 H -4.0899 -0.6234 -0.6634 H 1 UNL1111111111 0.1660 27 H 1.0166 2.5388 0.3995 H 1 UNL1111111111 0.1527 28 H 1.9336 -0.7944 -2.4125 H 1 UNL1111111111 0.1595 29 H 1.1066 -2.0357 -1.4797 H 1 UNL1111111111 0.1542 30 H 0.2539 -1.1854 -2.7835 H 1 UNL1111111111 0.1530 31 H -2.8370 -1.5868 1.5068 H 1 UNL1111111111 0.1644 32 H -4.3316 -0.7186 1.8561 H 1 UNL1111111111 0.1432 33 H -2.8816 -0.3785 2.8058 H 1 UNL1111111111 0.1400 34 H -3.2627 2.5867 0.4322 H 1 UNL1111111111 0.1443 35 H -3.2390 2.1322 2.1405 H 1 UNL1111111111 0.1472 36 H -4.6143 1.6875 1.1263 H 1 UNL1111111111 0.1473 37 H -1.5748 -2.6937 -1.3086 H 1 UNL1111111111 0.3101 38 H 3.2054 1.9784 -1.2887 H 1 UNL1111111111 0.3209 39 H 3.1437 0.4119 2.7674 H 1 UNL1111111111 0.1591 40 H 3.5664 1.4845 1.4227 H 1 UNL1111111111 0.1758 41 H 4.4027 -0.0658 1.6102 H 1 UNL1111111111 0.1689 42 H 1.4789 -2.1317 1.5419 H 1 UNL1111111111 0.1157 @BOND 1 1 8 1 2 1 37 1 3 2 12 1 4 2 38 1 5 3 18 2 6 4 5 1 7 4 9 1 8 4 11 1 9 4 13 1 10 5 6 1 11 5 8 1 12 5 19 1 13 6 7 1 14 6 20 1 15 6 21 1 16 7 10 1 17 7 14 1 18 7 15 1 19 8 10 1 20 8 22 1 21 9 12 1 22 9 23 1 23 9 24 1 24 10 25 1 25 10 26 1 26 11 12 1 27 11 16 2 28 12 27 1 29 13 28 1 30 13 29 1 31 13 30 1 32 14 31 1 33 14 32 1 34 14 33 1 35 15 34 1 36 15 35 1 37 15 36 1 38 16 17 1 39 16 18 1 40 17 39 1 41 17 40 1 42 17 41 1 43 18 42 1