@MOLECULE 12-methylgona-1(10),2,4,6,8,11,13-heptaen-17-one 33 36 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.5588 0.7997 0.0001 O.2 1 UNL111111111 -0.4548 2 C -1.4932 -0.9057 -0.0004 C.ar 1 UNL111111111 0.0858 3 C -2.4076 -2.0979 -0.0002 C.3 1 UNL111111111 -0.2780 4 C -2.2111 0.2869 -0.0002 C.ar 1 UNL111111111 -0.2472 5 C -0.0912 -0.9047 -0.0004 C.ar 1 UNL111111111 -0.0935 6 C -3.8361 -1.5092 0.0006 C.3 1 UNL111111111 -0.3796 7 C 0.5757 0.3437 -0.0004 C.ar 1 UNL111111111 0.0686 8 C -1.5627 1.5272 -0.0001 C.ar 1 UNL111111111 0.1479 9 C -3.6589 0.0043 0.0001 C.2 1 UNL111111111 0.4988 10 C -0.1739 1.5371 -0.0005 C.ar 1 UNL111111111 -0.2523 11 C 2.0268 0.3597 -0.0001 C.ar 1 UNL111111111 -0.0365 12 C 0.6616 -2.1281 -0.0001 C.ar 1 UNL111111111 -0.1225 13 C 2.7316 -0.8598 0.0002 C.ar 1 UNL111111111 0.0162 14 C 2.0160 -2.1081 0.0001 C.ar 1 UNL111111111 -0.1735 15 C -2.3529 2.7840 0.0005 C.3 1 UNL111111111 -0.4597 16 C 2.7629 1.5646 -0.0002 C.ar 1 UNL111111111 -0.1358 17 C 4.1434 -0.8578 0.0004 C.ar 1 UNL111111111 -0.1637 18 C 4.1429 1.5531 -0.0000 C.ar 1 UNL111111111 -0.1537 19 C 4.8408 0.3324 0.0003 C.ar 1 UNL111111111 -0.1338 20 H -2.2343 -2.7371 -0.8858 H 1 UNL111111111 0.1619 21 H -2.2332 -2.7380 0.8845 H 1 UNL111111111 0.1619 22 H -4.4186 -1.8270 0.8820 H 1 UNL111111111 0.1726 23 H -4.4199 -1.8280 -0.8796 H 1 UNL111111111 0.1726 24 H 0.3461 2.4940 -0.0007 H 1 UNL111111111 0.1652 25 H 0.1109 -3.0679 -0.0002 H 1 UNL111111111 0.1535 26 H 2.5972 -3.0288 0.0003 H 1 UNL111111111 0.1566 27 H -3.0265 2.8290 0.8744 H 1 UNL111111111 0.1782 28 H -3.0183 2.8345 -0.8790 H 1 UNL111111111 0.1780 29 H -1.7358 3.6898 0.0063 H 1 UNL111111111 0.1548 30 H 2.2342 2.5181 -0.0004 H 1 UNL111111111 0.1556 31 H 4.6751 -1.8072 0.0008 H 1 UNL111111111 0.1535 32 H 4.7008 2.4873 -0.0002 H 1 UNL111111111 0.1520 33 H 5.9295 0.3373 0.0004 H 1 UNL111111111 0.1505 @BOND 1 1 9 2 2 2 3 1 3 2 4 ar 4 2 5 ar 5 3 6 1 6 3 20 1 7 3 21 1 8 4 8 ar 9 4 9 1 10 5 7 ar 11 5 12 ar 12 6 9 1 13 6 22 1 14 6 23 1 15 7 10 ar 16 7 11 ar 17 8 10 ar 18 8 15 1 19 10 24 1 20 11 13 ar 21 11 16 ar 22 12 14 ar 23 12 25 1 24 13 14 ar 25 13 17 ar 26 14 26 1 27 15 27 1 28 15 28 1 29 15 29 1 30 16 18 ar 31 16 30 1 32 17 19 ar 33 17 31 1 34 18 19 ar 35 18 32 1 36 19 33 1