@MOLECULE 2-tetradecylcyclobutanone 53 53 0 0 0 SMALL GASTEIGER @ATOM 1 O 6.6495 -2.0872 0.1571 O.2 1 UNL1111111111 -0.4202 2 C 6.8646 0.3205 -0.5115 C.3 1 UNL1111111111 -0.2232 3 C 8.1996 0.8735 0.0899 C.3 1 UNL1111111111 -0.2750 4 C 5.5981 0.9668 0.0178 C.3 1 UNL1111111111 -0.2686 5 C 8.5082 -0.5198 0.7085 C.3 1 UNL1111111111 -0.3969 6 C 7.1983 -1.0336 0.1264 C.2 1 UNL1111111111 0.4799 7 C 4.3564 0.2334 -0.5069 C.3 1 UNL1111111111 -0.2757 8 C 3.0783 0.8404 0.0827 C.3 1 UNL1111111111 -0.2712 9 C 1.8410 0.0969 -0.4366 C.3 1 UNL1111111111 -0.2700 10 C 0.5592 0.7016 0.1497 C.3 1 UNL1111111111 -0.2736 11 C -0.6771 -0.0454 -0.3666 C.3 1 UNL1111111111 -0.2722 12 C -1.9599 0.5613 0.2158 C.3 1 UNL1111111111 -0.2734 13 C -3.1958 -0.1875 -0.2989 C.3 1 UNL1111111111 -0.2725 14 C -4.4789 0.4200 0.2819 C.3 1 UNL1111111111 -0.2719 15 C -5.7143 -0.3283 -0.2348 C.3 1 UNL1111111111 -0.2721 16 C -6.9977 0.2748 0.3501 C.3 1 UNL1111111111 -0.2748 17 C -8.2331 -0.4707 -0.1702 C.3 1 UNL1111111111 -0.2721 18 C -9.5183 0.1318 0.4130 C.3 1 UNL1111111111 -0.2511 19 C -10.7511 -0.6123 -0.1006 C.3 1 UNL1111111111 -0.4398 20 H 6.8658 0.2848 -1.6146 H 1 UNL1111111111 0.1617 21 H 8.9221 1.2099 -0.6557 H 1 UNL1111111111 0.1446 22 H 8.0684 1.6730 0.8220 H 1 UNL1111111111 0.1472 23 H 5.5944 0.9692 1.1255 H 1 UNL1111111111 0.1435 24 H 5.5667 2.0323 -0.2836 H 1 UNL1111111111 0.1437 25 H 9.4042 -1.0152 0.3243 H 1 UNL1111111111 0.1684 26 H 8.5608 -0.5441 1.8009 H 1 UNL1111111111 0.1691 27 H 4.4204 -0.8442 -0.2503 H 1 UNL1111111111 0.1578 28 H 4.3249 0.2763 -1.6111 H 1 UNL1111111111 0.1381 29 H 3.0118 1.9135 -0.1752 H 1 UNL1111111111 0.1340 30 H 3.1102 0.7933 1.1874 H 1 UNL1111111111 0.1370 31 H 1.8091 0.1382 -1.5411 H 1 UNL1111111111 0.1360 32 H 1.9079 -0.9764 -0.1751 H 1 UNL1111111111 0.1412 33 H 0.4909 1.7735 -0.1127 H 1 UNL1111111111 0.1345 34 H 0.5918 0.6609 1.2544 H 1 UNL1111111111 0.1367 35 H -0.6103 -1.1170 -0.1005 H 1 UNL1111111111 0.1380 36 H -0.7084 -0.0084 -1.4714 H 1 UNL1111111111 0.1361 37 H -1.9282 0.5252 1.3207 H 1 UNL1111111111 0.1364 38 H -2.0276 1.6322 -0.0510 H 1 UNL1111111111 0.1356 39 H -3.1285 -1.2583 -0.0303 H 1 UNL1111111111 0.1370 40 H -3.2266 -0.1530 -1.4038 H 1 UNL1111111111 0.1363 41 H -4.5457 1.4910 0.0148 H 1 UNL1111111111 0.1359 42 H -4.4489 0.3838 1.3868 H 1 UNL1111111111 0.1363 43 H -5.7467 -0.2886 -1.3395 H 1 UNL1111111111 0.1363 44 H -5.6455 -1.4002 0.0285 H 1 UNL1111111111 0.1367 45 H -6.9669 0.2320 1.4547 H 1 UNL1111111111 0.1363 46 H -7.0649 1.3474 0.0897 H 1 UNL1111111111 0.1360 47 H -8.2643 -0.4293 -1.2748 H 1 UNL1111111111 0.1364 48 H -8.1669 -1.5432 0.0905 H 1 UNL1111111111 0.1366 49 H -9.4867 0.0929 1.5181 H 1 UNL1111111111 0.1335 50 H -9.5869 1.2039 0.1492 H 1 UNL1111111111 0.1333 51 H -10.8235 -0.5613 -1.1926 H 1 UNL1111111111 0.1422 52 H -10.7247 -1.6714 0.1789 H 1 UNL1111111111 0.1423 53 H -11.6725 -0.1860 0.3109 H 1 UNL1111111111 0.1398 @BOND 1 1 6 2 2 2 3 1 3 2 4 1 4 2 6 1 5 2 20 1 6 3 5 1 7 3 21 1 8 3 22 1 9 4 7 1 10 4 23 1 11 4 24 1 12 5 6 1 13 5 25 1 14 5 26 1 15 7 8 1 16 7 27 1 17 7 28 1 18 8 9 1 19 8 29 1 20 8 30 1 21 9 10 1 22 9 31 1 23 9 32 1 24 10 11 1 25 10 33 1 26 10 34 1 27 11 12 1 28 11 35 1 29 11 36 1 30 12 13 1 31 12 37 1 32 12 38 1 33 13 14 1 34 13 39 1 35 13 40 1 36 14 15 1 37 14 41 1 38 14 42 1 39 15 16 1 40 15 43 1 41 15 44 1 42 16 17 1 43 16 45 1 44 16 46 1 45 17 18 1 46 17 47 1 47 17 48 1 48 18 19 1 49 18 49 1 50 18 50 1 51 19 51 1 52 19 52 1 53 19 53 1