@MOLECULE (3a's,6's,6a's)-6'-[(2r)-1,4-dioxaspiro[4.5]dec-2-yl]dihydrospiro[cyclohexane-1,2'-furo[3,4-d][1,3]dioxol]-4'(3a'h)-one 50 54 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.0998 0.7086 -0.3705 O.3 1 UNL1111111111 -0.4346 2 O 2.8035 -0.5493 -1.2608 O.3 1 UNL1111111111 -0.4152 3 O -2.2014 -0.7623 -0.4888 O.3 1 UNL1111111111 -0.4548 4 O 0.7678 -2.4752 0.4915 O.3 1 UNL1111111111 -0.4170 5 O -2.9359 -0.6952 1.6905 O.3 1 UNL1111111111 -0.4623 6 O 2.4426 -3.5027 -0.5414 O.2 1 UNL1111111111 -0.3910 7 C 0.4916 -0.4814 -0.8231 C.3 1 UNL1111111111 0.0408 8 C 2.5178 0.5575 -0.3915 C.3 1 UNL1111111111 0.4656 9 C -0.0292 -1.2942 0.3802 C.3 1 UNL1111111111 0.0166 10 C 1.6424 -1.3288 -1.4094 C.3 1 UNL1111111111 -0.0248 11 C -1.4811 -1.7690 0.1966 C.3 1 UNL1111111111 0.0557 12 C -2.9353 0.0184 0.4559 C.3 1 UNL1111111111 0.4822 13 C 3.1117 1.8030 -1.0407 C.3 1 UNL1111111111 -0.3206 14 C 3.0426 0.2427 1.0074 C.3 1 UNL1111111111 -0.3483 15 C -2.2251 -1.9155 1.5351 C.3 1 UNL1111111111 -0.0613 16 C -2.2350 1.3566 0.6958 C.3 1 UNL1111111111 -0.3378 17 C -4.3735 0.1195 -0.0500 C.3 1 UNL1111111111 -0.3309 18 C 2.9568 2.9997 -0.0973 C.3 1 UNL1111111111 -0.2562 19 C 2.8803 1.4717 1.9055 C.3 1 UNL1111111111 -0.2506 20 C 1.7217 -2.5544 -0.4997 C.2 1 UNL1111111111 0.5433 21 C 3.5637 2.6940 1.2783 C.3 1 UNL1111111111 -0.2705 22 C -2.3606 2.2524 -0.5389 C.3 1 UNL1111111111 -0.2511 23 C -4.4425 1.0416 -1.2697 C.3 1 UNL1111111111 -0.2574 24 C -3.8289 2.4114 -0.9527 C.3 1 UNL1111111111 -0.2694 25 H -0.2964 -0.1581 -1.5310 H 1 UNL1111111111 0.1854 26 H 0.1237 -0.7433 1.3351 H 1 UNL1111111111 0.1716 27 H 1.5749 -1.5916 -2.4807 H 1 UNL1111111111 0.1811 28 H -1.5382 -2.6673 -0.4520 H 1 UNL1111111111 0.1625 29 H 2.6103 2.0007 -2.0079 H 1 UNL1111111111 0.1604 30 H 4.1774 1.6206 -1.2799 H 1 UNL1111111111 0.1608 31 H 4.1072 -0.0572 0.9387 H 1 UNL1111111111 0.1648 32 H 2.5147 -0.6297 1.4367 H 1 UNL1111111111 0.1596 33 H -2.9671 -2.7304 1.5287 H 1 UNL1111111111 0.1380 34 H -1.5750 -2.0032 2.4200 H 1 UNL1111111111 0.1526 35 H -1.1675 1.1911 0.9409 H 1 UNL1111111111 0.1612 36 H -2.6800 1.8436 1.5846 H 1 UNL1111111111 0.1595 37 H -5.0178 0.4954 0.7682 H 1 UNL1111111111 0.1594 38 H -4.7542 -0.8885 -0.3012 H 1 UNL1111111111 0.1561 39 H 1.8820 3.2491 0.0124 H 1 UNL1111111111 0.1500 40 H 3.4353 3.8931 -0.5377 H 1 UNL1111111111 0.1337 41 H 3.3024 1.2683 2.9068 H 1 UNL1111111111 0.1369 42 H 1.8033 1.6816 2.0614 H 1 UNL1111111111 0.1472 43 H 4.6509 2.5156 1.1836 H 1 UNL1111111111 0.1395 44 H 3.4559 3.5709 1.9426 H 1 UNL1111111111 0.1348 45 H -1.7769 1.8181 -1.3747 H 1 UNL1111111111 0.1454 46 H -1.9091 3.2408 -0.3348 H 1 UNL1111111111 0.1363 47 H -5.4914 1.1574 -1.5982 H 1 UNL1111111111 0.1337 48 H -3.9037 0.5752 -2.1186 H 1 UNL1111111111 0.1469 49 H -4.4000 2.9066 -0.1459 H 1 UNL1111111111 0.1382 50 H -3.9054 3.0743 -1.8339 H 1 UNL1111111111 0.1339 @BOND 1 1 7 1 2 1 8 1 3 2 8 1 4 2 10 1 5 3 11 1 6 3 12 1 7 4 9 1 8 4 20 1 9 5 12 1 10 5 15 1 11 6 20 2 12 7 9 1 13 7 10 1 14 7 25 1 15 8 13 1 16 8 14 1 17 9 11 1 18 9 26 1 19 10 20 1 20 10 27 1 21 11 15 1 22 11 28 1 23 12 16 1 24 12 17 1 25 13 18 1 26 13 29 1 27 13 30 1 28 14 19 1 29 14 31 1 30 14 32 1 31 15 33 1 32 15 34 1 33 16 22 1 34 16 35 1 35 16 36 1 36 17 23 1 37 17 37 1 38 17 38 1 39 18 21 1 40 18 39 1 41 18 40 1 42 19 21 1 43 19 41 1 44 19 42 1 45 21 43 1 46 21 44 1 47 22 24 1 48 22 45 1 49 22 46 1 50 23 24 1 51 23 47 1 52 23 48 1 53 24 49 1 54 24 50 1