@MOLECULE (1S,2S)-1-methyl-2-[(E)-2-methylpent-1-enyl]cyclobutane 31 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.6050 -0.1314 -0.7133 C.3 1 UNL11111111 -0.0924 2 H 2.2853 -0.4559 -1.7174 H 1 UNL11111111 0.1349 3 C 3.5996 1.0073 -0.8094 C.3 1 UNL11111111 -0.4527 4 C 3.0460 -1.3211 0.1891 C.3 1 UNL11111111 -0.2947 5 C 1.8263 -1.0856 1.1135 C.3 1 UNL11111111 -0.2807 6 C 1.3975 0.1427 0.2496 C.3 1 UNL11111111 -0.1210 7 H 1.5084 1.0994 0.7883 H 1 UNL11111111 0.1420 8 C 0.0590 -0.0045 -0.3686 C.2 1 UNL11111111 -0.2374 9 C -1.0397 0.6443 0.0410 C.2 1 UNL11111111 0.0314 10 C -1.0448 1.6178 1.1727 C.3 1 UNL11111111 -0.4544 11 C -2.3609 0.4207 -0.6362 C.3 1 UNL11111111 -0.2910 12 C -3.2199 -0.5533 0.1874 C.3 1 UNL11111111 -0.2382 13 C -4.5788 -0.7789 -0.4738 C.3 1 UNL11111111 -0.4420 14 H 4.4887 0.7110 -1.3783 H 1 UNL11111111 0.1451 15 H 3.1572 1.8758 -1.3129 H 1 UNL11111111 0.1470 16 H 3.9385 1.3392 0.1791 H 1 UNL11111111 0.1458 17 H 3.0533 -2.2889 -0.3155 H 1 UNL11111111 0.1365 18 H 4.0141 -1.1852 0.6751 H 1 UNL11111111 0.1391 19 H 1.0994 -1.9011 1.1208 H 1 UNL11111111 0.1426 20 H 2.0746 -0.8413 2.1468 H 1 UNL11111111 0.1346 21 H 0.0135 -0.7109 -1.1966 H 1 UNL11111111 0.1494 22 H -0.5423 2.5536 0.8866 H 1 UNL11111111 0.1571 23 H -2.0593 1.8811 1.4986 H 1 UNL11111111 0.1519 24 H -0.5191 1.2192 2.0521 H 1 UNL11111111 0.1565 25 H -2.8947 1.3823 -0.7692 H 1 UNL11111111 0.1459 26 H -2.2222 0.0213 -1.6604 H 1 UNL11111111 0.1449 27 H -2.6856 -1.5163 0.3005 H 1 UNL11111111 0.1388 28 H -3.3552 -0.1626 1.2136 H 1 UNL11111111 0.1354 29 H -4.4703 -1.1993 -1.4799 H 1 UNL11111111 0.1431 30 H -5.1921 -1.4753 0.1088 H 1 UNL11111111 0.1409 31 H -5.1417 0.1564 -0.5658 H 1 UNL11111111 0.1415 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 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 9 11 1 12 11 12 1 13 12 13 1 14 3 14 1 15 3 15 1 16 3 16 1 17 4 17 1 18 4 18 1 19 5 19 1 20 5 20 1 21 8 21 1 22 10 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