@MOLECULE (1s,4r,5s)-5-isopropenyl-6-methylene-2-cyclohexene-1,4-diol 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.4398 -1.0808 -0.5319 O.3 1 UNL1111111111 -0.5502 2 O 2.1927 0.0976 1.1925 O.3 1 UNL1111111111 -0.5364 3 C -0.5050 0.3789 -0.7402 C.3 1 UNL1111111111 -0.2131 4 C -1.0562 -1.0687 -0.7813 C.3 1 UNL1111111111 0.1505 5 C 0.9927 0.3382 -0.8580 C.2 1 UNL1111111111 -0.0359 6 C 1.7370 -0.6103 0.0544 C.3 1 UNL1111111111 0.1324 7 C -0.8811 1.1681 0.4906 C.2 1 UNL1111111111 0.0957 8 C -0.3351 -1.9976 0.1484 C.2 1 UNL1111111111 -0.2010 9 C 0.9322 -1.7966 0.5077 C.2 1 UNL1111111111 -0.2062 10 C -1.0062 2.6376 0.2496 C.3 1 UNL1111111111 -0.4710 11 C 1.6560 1.1227 -1.7084 C.2 1 UNL1111111111 -0.3153 12 C -1.0815 0.6432 1.7019 C.2 1 UNL1111111111 -0.4220 13 H -0.9457 0.9033 -1.6330 H 1 UNL1111111111 0.1691 14 H -1.0096 -1.4636 -1.8303 H 1 UNL1111111111 0.1561 15 H 2.6996 -0.9461 -0.4120 H 1 UNL1111111111 0.1564 16 H -0.9228 -2.8507 0.4848 H 1 UNL1111111111 0.1666 17 H 1.4695 -2.4661 1.1779 H 1 UNL1111111111 0.1638 18 H -0.1182 3.0366 -0.2641 H 1 UNL1111111111 0.1648 19 H -1.8796 2.8650 -0.3797 H 1 UNL1111111111 0.1644 20 H -1.1228 3.2116 1.1790 H 1 UNL1111111111 0.1609 21 H 1.1835 1.8303 -2.3715 H 1 UNL1111111111 0.1488 22 H 2.7329 1.1233 -1.8007 H 1 UNL1111111111 0.1570 23 H -2.6512 -0.6773 0.3377 H 1 UNL1111111111 0.3250 24 H -1.3481 1.2307 2.5661 H 1 UNL1111111111 0.1576 25 H -0.9934 -0.4054 1.9373 H 1 UNL1111111111 0.1596 26 H 1.4312 0.4965 1.6713 H 1 UNL1111111111 0.3224 @BOND 1 1 4 1 2 1 23 1 3 2 6 1 4 2 26 1 5 3 4 1 6 3 5 1 7 3 7 1 8 3 13 1 9 4 8 1 10 4 14 1 11 5 6 1 12 5 11 2 13 6 9 1 14 6 15 1 15 7 10 1 16 7 12 2 17 8 9 2 18 8 16 1 19 9 17 1 20 10 18 1 21 10 19 1 22 10 20 1 23 11 21 1 24 11 22 1 25 12 24 1 26 12 25 1