@MOLECULE (4r,4as,7r,7ar)-7-hydroxy-4,7-dimethylhexahydrocyclopenta[c]pyran-3(1h)-one 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.3748 1.7000 -0.0760 O.3 1 UNL1111111111 -0.4109 2 O 2.2651 0.7058 -1.1609 O.3 1 UNL1111111111 -0.5826 3 O -3.3060 0.7650 0.3414 O.2 1 UNL1111111111 -0.4530 4 C 0.6004 0.4455 0.4908 C.3 1 UNL1111111111 -0.2083 5 C -0.1882 -0.8856 0.4191 C.3 1 UNL1111111111 -0.1060 6 C 2.0680 0.1214 0.1124 C.3 1 UNL1111111111 0.3369 7 C 0.7441 -1.9051 -0.2671 C.3 1 UNL1111111111 -0.2673 8 C 2.1717 -1.4148 0.0015 C.3 1 UNL1111111111 -0.3401 9 C -1.5197 -0.7335 -0.3370 C.3 1 UNL1111111111 -0.2119 10 C -0.0139 1.4912 -0.4384 C.3 1 UNL1111111111 -0.0141 11 C 3.0836 0.7134 1.0870 C.3 1 UNL1111111111 -0.5161 12 C -2.1637 0.5893 0.0127 C.2 1 UNL1111111111 0.5825 13 C -2.4769 -1.8750 -0.0056 C.3 1 UNL1111111111 -0.4337 14 H 0.5617 0.8374 1.5339 H 1 UNL1111111111 0.1583 15 H -0.4021 -1.2292 1.4586 H 1 UNL1111111111 0.1451 16 H 0.5539 -1.9459 -1.3548 H 1 UNL1111111111 0.1469 17 H 0.5794 -2.9246 0.1134 H 1 UNL1111111111 0.1377 18 H 2.5697 -1.8513 0.9320 H 1 UNL1111111111 0.1476 19 H 2.8623 -1.7131 -0.8024 H 1 UNL1111111111 0.1463 20 H -1.3240 -0.7286 -1.4438 H 1 UNL1111111111 0.1715 21 H 0.4299 2.4952 -0.3067 H 1 UNL1111111111 0.1554 22 H 0.0359 1.2095 -1.5057 H 1 UNL1111111111 0.1481 23 H 2.9070 0.3774 2.1144 H 1 UNL1111111111 0.1601 24 H 4.1092 0.4362 0.8223 H 1 UNL1111111111 0.1509 25 H 3.0308 1.8107 1.0824 H 1 UNL1111111111 0.1681 26 H -2.7401 -1.8884 1.0604 H 1 UNL1111111111 0.1580 27 H -2.0454 -2.8489 -0.2592 H 1 UNL1111111111 0.1458 28 H -3.4236 -1.7712 -0.5552 H 1 UNL1111111111 0.1634 29 H 3.1686 0.5527 -1.4898 H 1 UNL1111111111 0.3215 @BOND 1 1 10 1 2 1 12 1 3 2 6 1 4 2 29 1 5 3 12 2 6 4 5 1 7 4 6 1 8 4 10 1 9 4 14 1 10 5 7 1 11 5 9 1 12 5 15 1 13 6 8 1 14 6 11 1 15 7 8 1 16 7 16 1 17 7 17 1 18 8 18 1 19 8 19 1 20 9 12 1 21 9 13 1 22 9 20 1 23 10 21 1 24 10 22 1 25 11 23 1 26 11 24 1 27 11 25 1 28 13 26 1 29 13 27 1 30 13 28 1