@MOLECULE (1r,4s,5r,8s,9r,10r,12r,13r)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.0~4,13~.0~8,13~]hexadecan-10-ol 44 47 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2304 0.5945 -1.4823 O.3 1 UNL1111111111 -0.1516 2 O 0.9320 1.4828 1.1252 O.3 1 UNL1111111111 -0.4309 3 O -1.2699 1.1771 0.9993 O.3 1 UNL1111111111 -0.5202 4 O 0.3847 1.9484 -1.0657 O.3 1 UNL1111111111 -0.1653 5 O -3.4602 1.3773 0.6646 O.3 1 UNL1111111111 -0.5564 6 C 0.1586 -0.2846 -0.3592 C.3 1 UNL1111111111 0.0457 7 C 1.4926 -1.0690 -0.3658 C.3 1 UNL1111111111 -0.1554 8 C -1.0615 -1.1728 -0.6766 C.3 1 UNL1111111111 -0.1434 9 C 1.4062 -2.3214 0.5354 C.3 1 UNL1111111111 -0.0871 10 C -0.0360 0.4905 0.9641 C.3 1 UNL1111111111 0.3391 11 C -1.1087 -2.3742 0.2730 C.3 1 UNL1111111111 -0.2779 12 C -2.3219 -0.2939 -0.6355 C.3 1 UNL1111111111 -0.1940 13 C 2.6713 -0.1810 0.0768 C.3 1 UNL1111111111 -0.2674 14 C 0.1875 -3.1792 0.1546 C.3 1 UNL1111111111 -0.2865 15 C 1.4172 2.0225 -0.1057 C.3 1 UNL1111111111 0.3894 16 C 2.6541 1.2211 -0.5400 C.3 1 UNL1111111111 -0.3391 17 C -2.4368 0.4241 0.7219 C.3 1 UNL1111111111 0.3778 18 C 2.6748 -3.1738 0.4076 C.3 1 UNL1111111111 -0.4555 19 C -3.6004 -1.0798 -0.9067 C.3 1 UNL1111111111 -0.4368 20 C 1.6355 3.5067 0.1355 C.3 1 UNL1111111111 -0.4802 21 H 1.6727 -1.3957 -1.4199 H 1 UNL1111111111 0.1525 22 H -0.9467 -1.5585 -1.7227 H 1 UNL1111111111 0.1562 23 H 1.2988 -1.9963 1.5981 H 1 UNL1111111111 0.1359 24 H 0.0468 -0.1290 1.8824 H 1 UNL1111111111 0.1365 25 H -1.9746 -3.0179 0.0239 H 1 UNL1111111111 0.1471 26 H -1.2679 -2.0510 1.3176 H 1 UNL1111111111 0.1401 27 H -2.2113 0.4965 -1.4264 H 1 UNL1111111111 0.1729 28 H 3.6219 -0.6808 -0.1957 H 1 UNL1111111111 0.1388 29 H 2.6865 -0.0935 1.1830 H 1 UNL1111111111 0.1551 30 H 0.1384 -4.0707 0.8068 H 1 UNL1111111111 0.1384 31 H 0.3030 -3.5673 -0.8746 H 1 UNL1111111111 0.1416 32 H 3.5744 1.7611 -0.2487 H 1 UNL1111111111 0.1515 33 H 2.6709 1.1552 -1.6467 H 1 UNL1111111111 0.1660 34 H -2.6883 -0.2192 1.5874 H 1 UNL1111111111 0.1269 35 H 2.5823 -4.1088 0.9713 H 1 UNL1111111111 0.1435 36 H 2.8807 -3.4379 -0.6353 H 1 UNL1111111111 0.1456 37 H 3.5551 -2.6514 0.7973 H 1 UNL1111111111 0.1458 38 H -4.4689 -0.4041 -0.9270 H 1 UNL1111111111 0.1624 39 H -3.5583 -1.5928 -1.8734 H 1 UNL1111111111 0.1439 40 H -3.8008 -1.8310 -0.1356 H 1 UNL1111111111 0.1420 41 H 2.1390 3.9852 -0.7108 H 1 UNL1111111111 0.1612 42 H 0.6747 4.0202 0.2977 H 1 UNL1111111111 0.1781 43 H 2.2347 3.6650 1.0425 H 1 UNL1111111111 0.1726 44 H -3.1174 2.2264 0.3025 H 1 UNL1111111111 0.3413 @BOND 1 1 4 1 2 1 6 1 3 2 10 1 4 2 15 1 5 3 10 1 6 3 17 1 7 4 15 1 8 5 17 1 9 5 44 1 10 6 7 1 11 6 8 1 12 6 10 1 13 7 9 1 14 7 13 1 15 7 21 1 16 8 11 1 17 8 12 1 18 8 22 1 19 9 14 1 20 9 18 1 21 9 23 1 22 10 24 1 23 11 14 1 24 11 25 1 25 11 26 1 26 12 17 1 27 12 19 1 28 12 27 1 29 13 16 1 30 13 28 1 31 13 29 1 32 14 30 1 33 14 31 1 34 15 16 1 35 15 20 1 36 16 32 1 37 16 33 1 38 17 34 1 39 18 35 1 40 18 36 1 41 18 37 1 42 19 38 1 43 19 39 1 44 19 40 1 45 20 41 1 46 20 42 1 47 20 43 1