@MOLECULE cinnamyl alcohol 20 20 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.1945 -0.5703 -0.1352 O.3 1 UNL1111111111 -0.5395 2 C 0.5897 0.3067 0.0010 C.ar 1 UNL1111111111 0.0003 3 C -0.8016 0.7506 0.0090 C.2 1 UNL1111111111 -0.1769 4 C 0.9441 -1.0458 0.0387 C.ar 1 UNL1111111111 -0.1548 5 C 1.6044 1.2737 -0.0468 C.ar 1 UNL1111111111 -0.1587 6 C 2.2843 -1.4239 0.0295 C.ar 1 UNL1111111111 -0.1441 7 C 2.9426 0.8933 -0.0554 C.ar 1 UNL1111111111 -0.1454 8 C -1.8626 -0.0591 0.1109 C.2 1 UNL1111111111 -0.1874 9 C 3.2864 -0.4571 -0.0171 C.ar 1 UNL1111111111 -0.1494 10 C -3.2637 0.4587 0.1397 C.3 1 UNL1111111111 -0.0079 11 H -0.9381 1.8335 -0.0718 H 1 UNL1111111111 0.1527 12 H 0.1721 -1.8134 0.0758 H 1 UNL1111111111 0.1526 13 H 1.3450 2.3304 -0.0760 H 1 UNL1111111111 0.1504 14 H 2.5487 -2.4792 0.0587 H 1 UNL1111111111 0.1505 15 H 3.7224 1.6519 -0.0916 H 1 UNL1111111111 0.1499 16 H -1.7809 -1.1418 0.2005 H 1 UNL1111111111 0.1637 17 H 4.3329 -0.7547 -0.0234 H 1 UNL1111111111 0.1502 18 H -3.5573 0.7824 1.1622 H 1 UNL1111111111 0.1566 19 H -3.4359 1.2932 -0.5656 H 1 UNL1111111111 0.1253 20 H -4.0315 -0.9553 -1.0191 H 1 UNL1111111111 0.3119 @BOND 1 1 10 1 2 1 20 1 3 2 3 1 4 2 4 ar 5 2 5 ar 6 3 8 2 7 3 11 1 8 4 6 ar 9 4 12 1 10 5 7 ar 11 5 13 1 12 6 9 ar 13 6 14 1 14 7 9 ar 15 7 15 1 16 8 10 1 17 8 16 1 18 9 17 1 19 10 18 1 20 10 19 1