@MOLECULE apiol 30 31 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.0786 2.2472 0.1760 O.3 1 UNL1111111111 -0.3427 2 O 2.7426 0.5784 0.2807 O.3 1 UNL1111111111 -0.3432 3 O -1.8499 1.5640 -0.3583 O.3 1 UNL1111111111 -0.2776 4 O 2.0401 -2.3884 -0.1069 O.3 1 UNL1111111111 -0.2834 5 C -1.1361 -0.6686 -0.4430 C.ar 1 UNL1111111111 -0.0121 6 C 0.5189 1.0057 -0.0291 C.ar 1 UNL1111111111 0.0541 7 C 1.5113 0.0097 0.0348 C.ar 1 UNL1111111111 0.0249 8 C -0.8062 0.6987 -0.2671 C.ar 1 UNL1111111111 0.1178 9 C 1.1979 -1.3241 -0.1386 C.ar 1 UNL1111111111 0.1617 10 C -0.1541 -1.6475 -0.3800 C.ar 1 UNL1111111111 -0.2258 11 C -2.5652 -1.0459 -0.6845 C.3 1 UNL1111111111 -0.2790 12 C 2.4866 1.9959 0.3759 C.3 1 UNL1111111111 0.1613 13 C -3.2369 -1.4096 0.6057 C.2 1 UNL1111111111 -0.0818 14 C -1.5208 2.9362 -0.1663 C.3 1 UNL1111111111 -0.2066 15 C 3.4084 -2.0722 0.1323 C.3 1 UNL1111111111 -0.2040 16 C -4.5134 -1.1254 0.8604 C.2 1 UNL1111111111 -0.3511 17 H -0.4139 -2.6980 -0.5155 H 1 UNL1111111111 0.1832 18 H -3.1069 -0.2189 -1.1977 H 1 UNL1111111111 0.1708 19 H -2.6301 -1.9062 -1.3890 H 1 UNL1111111111 0.1632 20 H 2.7411 2.3145 1.3961 H 1 UNL1111111111 0.1378 21 H 3.0332 2.4901 -0.4389 H 1 UNL1111111111 0.1374 22 H -2.6037 -1.9333 1.3221 H 1 UNL1111111111 0.1471 23 H -2.4960 3.4269 -0.2738 H 1 UNL1111111111 0.1471 24 H -0.8230 3.2811 -0.9365 H 1 UNL1111111111 0.1416 25 H -1.1111 3.1026 0.8355 H 1 UNL1111111111 0.1424 26 H 3.8851 -3.0597 0.1099 H 1 UNL1111111111 0.1467 27 H 3.5325 -1.6006 1.1129 H 1 UNL1111111111 0.1418 28 H 3.8040 -1.4298 -0.6614 H 1 UNL1111111111 0.1417 29 H -5.0091 -1.3929 1.7795 H 1 UNL1111111111 0.1432 30 H -5.1614 -0.5989 0.1790 H 1 UNL1111111111 0.1438 @BOND 1 1 6 1 2 1 12 1 3 2 7 1 4 2 12 1 5 3 8 1 6 3 14 1 7 4 9 1 8 4 15 1 9 5 8 ar 10 5 10 ar 11 5 11 1 12 6 7 ar 13 6 8 ar 14 7 9 ar 15 9 10 ar 16 10 17 1 17 11 13 1 18 11 18 1 19 11 19 1 20 12 20 1 21 12 21 1 22 13 16 2 23 13 22 1 24 14 23 1 25 14 24 1 26 14 25 1 27 15 26 1 28 15 27 1 29 15 28 1 30 16 29 1 31 16 30 1