@MOLECULE 2-naphthyl octanoate 42 43 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.5626 -0.4276 0.9676 O.3 1 UNL1111111111 -0.4392 2 O 0.2267 -0.1524 -1.1261 O.2 1 UNL1111111111 -0.4655 3 C 5.3969 0.1177 -0.4720 C.3 1 UNL1111111111 -0.2724 4 C 4.2465 -0.0785 0.5240 C.3 1 UNL1111111111 -0.2710 5 C 6.7438 0.1766 0.2586 C.3 1 UNL1111111111 -0.2757 6 C 2.9028 -0.1058 -0.2121 C.3 1 UNL1111111111 -0.2547 7 C 7.8937 0.3839 -0.7364 C.3 1 UNL1111111111 -0.2509 8 C 1.7481 -0.2757 0.7786 C.3 1 UNL1111111111 -0.3487 9 C 9.2386 0.4373 -0.0118 C.3 1 UNL1111111111 -0.4401 10 C 0.4430 -0.2697 0.0457 C.2 1 UNL1111111111 0.6113 11 C -1.8656 -0.4513 0.5103 C.ar 1 UNL1111111111 0.2482 12 C -3.9736 0.6444 0.1864 C.ar 1 UNL1111111111 0.0272 13 C -4.5437 -0.5979 -0.1746 C.ar 1 UNL1111111111 -0.0339 14 C -2.5967 0.7074 0.5332 C.ar 1 UNL1111111111 -0.2281 15 C -2.4088 -1.7083 0.1467 C.ar 1 UNL1111111111 -0.1985 16 C -3.7353 -1.7702 -0.1890 C.ar 1 UNL1111111111 -0.1194 17 C -4.7901 1.8092 0.1928 C.ar 1 UNL1111111111 -0.1593 18 C -5.9217 -0.6528 -0.5211 C.ar 1 UNL1111111111 -0.1384 19 C -6.1160 1.7285 -0.1458 C.ar 1 UNL1111111111 -0.1332 20 C -6.6892 0.4832 -0.5063 C.ar 1 UNL1111111111 -0.1565 21 H 5.4034 -0.7064 -1.2111 H 1 UNL1111111111 0.1390 22 H 5.2417 1.0450 -1.0544 H 1 UNL1111111111 0.1395 23 H 4.3934 -1.0172 1.0903 H 1 UNL1111111111 0.1373 24 H 4.2560 0.7344 1.2743 H 1 UNL1111111111 0.1376 25 H 6.9065 -0.7536 0.8338 H 1 UNL1111111111 0.1361 26 H 6.7378 0.9945 1.0027 H 1 UNL1111111111 0.1362 27 H 2.8890 -0.9246 -0.9591 H 1 UNL1111111111 0.1529 28 H 2.7669 0.8248 -0.7999 H 1 UNL1111111111 0.1543 29 H 7.8993 -0.4320 -1.4837 H 1 UNL1111111111 0.1346 30 H 7.7354 1.3177 -1.3085 H 1 UNL1111111111 0.1347 31 H 1.8561 -1.2187 1.3569 H 1 UNL1111111111 0.1800 32 H 1.7574 0.5329 1.5418 H 1 UNL1111111111 0.1808 33 H 9.4364 -0.4913 0.5350 H 1 UNL1111111111 0.1424 34 H 10.0638 0.5861 -0.7171 H 1 UNL1111111111 0.1415 35 H 9.2718 1.2595 0.7117 H 1 UNL1111111111 0.1424 36 H -2.1458 1.6565 0.8089 H 1 UNL1111111111 0.1738 37 H -1.7664 -2.5853 0.1422 H 1 UNL1111111111 0.1710 38 H -4.1935 -2.7166 -0.4749 H 1 UNL1111111111 0.1579 39 H -4.3398 2.7605 0.4698 H 1 UNL1111111111 0.1558 40 H -6.3528 -1.6134 -0.7982 H 1 UNL1111111111 0.1517 41 H -6.7475 2.6157 -0.1441 H 1 UNL1111111111 0.1496 42 H -7.7440 0.4482 -0.7706 H 1 UNL1111111111 0.1497 @BOND 1 1 10 1 2 1 11 1 3 2 10 2 4 3 4 1 5 3 5 1 6 3 21 1 7 3 22 1 8 4 6 1 9 4 23 1 10 4 24 1 11 5 7 1 12 5 25 1 13 5 26 1 14 6 8 1 15 6 27 1 16 6 28 1 17 7 9 1 18 7 29 1 19 7 30 1 20 8 10 1 21 8 31 1 22 8 32 1 23 9 33 1 24 9 34 1 25 9 35 1 26 11 14 ar 27 11 15 ar 28 12 13 ar 29 12 14 ar 30 12 17 ar 31 13 16 ar 32 13 18 ar 33 14 36 1 34 15 16 ar 35 15 37 1 36 16 38 1 37 17 19 ar 38 17 39 1 39 18 20 ar 40 18 40 1 41 19 20 ar 42 19 41 1 43 20 42 1