@MOLECULE 2-tetradecanone 43 42 0 0 0 SMALL GASTEIGER @ATOM 1 O -6.4586 1.3770 0.1112 O.2 1 UNL1111111111 -0.4559 2 C 1.0810 0.3448 -0.1216 C.3 1 UNL1111111111 -0.2718 3 C 2.3535 -0.5053 -0.0116 C.3 1 UNL1111111111 -0.2726 4 C -0.1693 -0.5403 -0.0480 C.3 1 UNL1111111111 -0.2747 5 C 3.6041 0.3810 -0.0744 C.3 1 UNL1111111111 -0.2718 6 C -1.4467 0.3067 -0.1070 C.3 1 UNL1111111111 -0.2698 7 C 4.8762 -0.4673 0.0490 C.3 1 UNL1111111111 -0.2748 8 C -2.6873 -0.5915 -0.0309 C.3 1 UNL1111111111 -0.2757 9 C 6.1266 0.4188 -0.0133 C.3 1 UNL1111111111 -0.2720 10 C -3.9680 0.2493 -0.0403 C.3 1 UNL1111111111 -0.2513 11 C 7.4005 -0.4271 0.1156 C.3 1 UNL1111111111 -0.2511 12 C -5.2081 -0.6476 0.0199 C.3 1 UNL1111111111 -0.3880 13 C 8.6485 0.4538 0.0523 C.3 1 UNL1111111111 -0.4398 14 C -6.4722 0.1741 0.0579 C.2 1 UNL1111111111 0.4974 15 C -7.7622 -0.5964 0.0305 C.3 1 UNL1111111111 -0.5578 16 H 1.0867 0.9147 -1.0693 H 1 UNL1111111111 0.1371 17 H 1.0590 1.0996 0.6865 H 1 UNL1111111111 0.1377 18 H 2.3445 -1.0802 0.9332 H 1 UNL1111111111 0.1360 19 H 2.3789 -1.2556 -0.8235 H 1 UNL1111111111 0.1358 20 H -0.1557 -1.1356 0.8839 H 1 UNL1111111111 0.1356 21 H -0.1628 -1.2724 -0.8767 H 1 UNL1111111111 0.1350 22 H 3.6182 0.9494 -1.0229 H 1 UNL1111111111 0.1367 23 H 3.5738 1.1373 0.7321 H 1 UNL1111111111 0.1369 24 H -1.4647 0.9049 -1.0381 H 1 UNL1111111111 0.1389 25 H -1.4557 1.0400 0.7219 H 1 UNL1111111111 0.1398 26 H 4.9072 -1.2222 -0.7578 H 1 UNL1111111111 0.1360 27 H 4.8618 -1.0359 0.9975 H 1 UNL1111111111 0.1362 28 H -2.6900 -1.3010 -0.8792 H 1 UNL1111111111 0.1345 29 H -2.6466 -1.2114 0.8845 H 1 UNL1111111111 0.1350 30 H 6.1438 0.9847 -0.9632 H 1 UNL1111111111 0.1366 31 H 6.0947 1.1778 0.7902 H 1 UNL1111111111 0.1367 32 H -4.0070 0.8881 -0.9443 H 1 UNL1111111111 0.1496 33 H -3.9728 0.9581 0.8118 H 1 UNL1111111111 0.1533 34 H 7.4331 -1.1868 -0.6880 H 1 UNL1111111111 0.1334 35 H 7.3846 -0.9922 1.0666 H 1 UNL1111111111 0.1334 36 H -5.1648 -1.3016 0.9141 H 1 UNL1111111111 0.1644 37 H -5.2277 -1.3328 -0.8504 H 1 UNL1111111111 0.1627 38 H 8.6562 1.1958 0.8585 H 1 UNL1111111111 0.1424 39 H 9.5617 -0.1439 0.1461 H 1 UNL1111111111 0.1399 40 H 8.7068 0.9978 -0.8969 H 1 UNL1111111111 0.1423 41 H -7.8484 -1.2687 0.8930 H 1 UNL1111111111 0.1714 42 H -8.6294 0.0813 0.0562 H 1 UNL1111111111 0.1812 43 H -7.8507 -1.2043 -0.8780 H 1 UNL1111111111 0.1713 @BOND 1 1 14 2 2 2 3 1 3 2 4 1 4 2 16 1 5 2 17 1 6 3 5 1 7 3 18 1 8 3 19 1 9 4 6 1 10 4 20 1 11 4 21 1 12 5 7 1 13 5 22 1 14 5 23 1 15 6 8 1 16 6 24 1 17 6 25 1 18 7 9 1 19 7 26 1 20 7 27 1 21 8 10 1 22 8 28 1 23 8 29 1 24 9 11 1 25 9 30 1 26 9 31 1 27 10 12 1 28 10 32 1 29 10 33 1 30 11 13 1 31 11 34 1 32 11 35 1 33 12 14 1 34 12 36 1 35 12 37 1 36 13 38 1 37 13 39 1 38 13 40 1 39 14 15 1 40 15 41 1 41 15 42 1 42 15 43 1