@MOLECULE 1-[(Z)-hex-1-enyl]-3-methyl-cyclobutane 31 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.8394 0.6509 0.8204 C.3 1 UNL11111111 -0.3052 2 C -3.2529 -0.7779 0.3598 C.3 1 UNL11111111 -0.0824 3 H -3.6527 -1.3901 1.1858 H 1 UNL11111111 0.1307 4 C -4.1839 -0.8177 -0.8356 C.3 1 UNL11111111 -0.4513 5 C -1.7643 -1.1020 0.0405 C.3 1 UNL11111111 -0.2974 6 C -1.3429 0.3162 0.5388 C.3 1 UNL11111111 -0.1110 7 H -0.7458 0.2812 1.4671 H 1 UNL11111111 0.1400 8 C -0.7013 1.1409 -0.5145 C.2 1 UNL11111111 -0.1795 9 C 0.6073 1.3990 -0.6023 C.2 1 UNL11111111 -0.1592 10 C 1.6561 0.9158 0.3451 C.3 1 UNL11111111 -0.2810 11 C 2.7294 0.1212 -0.4163 C.3 1 UNL11111111 -0.2613 12 C 3.8008 -0.4074 0.5464 C.3 1 UNL11111111 -0.2511 13 C 4.9005 -1.1457 -0.2172 C.3 1 UNL11111111 -0.4403 14 H -3.2479 1.4599 0.2123 H 1 UNL11111111 0.1441 15 H -3.0598 0.8719 1.8656 H 1 UNL11111111 0.1368 16 H -3.8008 -0.2186 -1.6707 H 1 UNL11111111 0.1479 17 H -4.3147 -1.8427 -1.2026 H 1 UNL11111111 0.1452 18 H -5.1758 -0.4267 -0.5800 H 1 UNL11111111 0.1447 19 H -1.3420 -1.9250 0.6174 H 1 UNL11111111 0.1366 20 H -1.5553 -1.2856 -1.0156 H 1 UNL11111111 0.1468 21 H -1.3918 1.5331 -1.2633 H 1 UNL11111111 0.1448 22 H 0.9966 2.0098 -1.4188 H 1 UNL11111111 0.1418 23 H 2.1186 1.7832 0.8606 H 1 UNL11111111 0.1461 24 H 1.2295 0.2866 1.1508 H 1 UNL11111111 0.1446 25 H 2.2581 -0.7200 -0.9588 H 1 UNL11111111 0.1412 26 H 3.1953 0.7583 -1.1905 H 1 UNL11111111 0.1365 27 H 4.2389 0.4288 1.1233 H 1 UNL11111111 0.1330 28 H 3.3396 -1.0825 1.2919 H 1 UNL11111111 0.1343 29 H 5.6676 -1.5305 0.4637 H 1 UNL11111111 0.1396 30 H 4.4972 -1.9982 -0.7753 H 1 UNL11111111 0.1430 31 H 5.4002 -0.4873 -0.9367 H 1 UNL11111111 0.1421 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 6 7 1 7 1 6 1 8 6 8 1 9 8 9 2 10 9 10 1 11 10 11 1 12 11 12 1 13 12 13 1 14 1 14 1 15 1 15 1 16 4 16 1 17 4 17 1 18 4 18 1 19 5 19 1 20 5 20 1 21 8 21 1 22 9 22 1 23 10 23 1 24 10 24 1 25 11 25 1 26 11 26 1 27 12 27 1 28 12 28 1 29 13 29 1 30 13 30 1 31 13 31 1