@MOLECULE (1R,2R)-1-[(E)-5,5-dimethylhex-1-enyl]-2-methyl-cyclobutane 37 37 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.5729 0.1259 1.6097 C.3 1 UNL11111111 -0.4652 2 C 3.5409 -0.1882 0.1064 C.3 1 UNL11111111 0.1272 3 C 4.2108 0.9535 -0.6736 C.3 1 UNL11111111 -0.4654 4 C 4.3253 -1.4908 -0.1464 C.3 1 UNL11111111 -0.4701 5 C 2.0888 -0.4045 -0.3760 C.3 1 UNL11111111 -0.2892 6 C 1.1870 0.8273 -0.2051 C.3 1 UNL11111111 -0.2765 7 C -0.1876 0.5191 -0.7040 C.2 1 UNL11111111 -0.1566 8 C -1.2825 0.6547 0.0498 C.2 1 UNL11111111 -0.1830 9 C -2.6405 0.3257 -0.4483 C.3 1 UNL11111111 -0.1343 10 H -2.6461 0.0839 -1.5249 H 1 UNL11111111 0.1421 11 C -3.3767 -0.7605 0.4139 C.3 1 UNL11111111 -0.0881 12 H -2.7966 -1.0560 1.3044 H 1 UNL11111111 0.1366 13 C -3.8258 -1.9802 -0.3636 C.3 1 UNL11111111 -0.4528 14 C -4.4962 0.2702 0.7422 C.3 1 UNL11111111 -0.2949 15 C -3.7458 1.3572 -0.0674 C.3 1 UNL11111111 -0.2821 16 H 3.0755 1.0750 1.8332 H 1 UNL11111111 0.1442 17 H 3.0717 -0.6551 2.1905 H 1 UNL11111111 0.1448 18 H 4.6017 0.2038 1.9761 H 1 UNL11111111 0.1431 19 H 5.2716 1.0395 -0.4165 H 1 UNL11111111 0.1433 20 H 4.1442 0.7898 -1.7538 H 1 UNL11111111 0.1440 21 H 3.7444 1.9193 -0.4546 H 1 UNL11111111 0.1441 22 H 3.8812 -2.3347 0.3907 H 1 UNL11111111 0.1438 23 H 4.3441 -1.7455 -1.2105 H 1 UNL11111111 0.1433 24 H 5.3637 -1.3993 0.1876 H 1 UNL11111111 0.1443 25 H 2.1012 -0.7073 -1.4400 H 1 UNL11111111 0.1378 26 H 1.6443 -1.2563 0.1743 H 1 UNL11111111 0.1425 27 H 1.1735 1.1444 0.8560 H 1 UNL11111111 0.1444 28 H 1.6012 1.6894 -0.7678 H 1 UNL11111111 0.1481 29 H -0.2342 0.1709 -1.7342 H 1 UNL11111111 0.1430 30 H -1.2363 1.0033 1.0799 H 1 UNL11111111 0.1466 31 H -2.9645 -2.5479 -0.7377 H 1 UNL11111111 0.1480 32 H -4.4196 -2.6556 0.2638 H 1 UNL11111111 0.1455 33 H -4.4424 -1.7108 -1.2293 H 1 UNL11111111 0.1467 34 H -5.4800 0.0108 0.3454 H 1 UNL11111111 0.1401 35 H -4.6077 0.4895 1.8056 H 1 UNL11111111 0.1366 36 H -3.3907 2.2020 0.5265 H 1 UNL11111111 0.1410 37 H -4.2986 1.7527 -0.9214 H 1 UNL11111111 0.1373 @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 7 8 2 8 8 9 1 9 9 10 1 10 9 11 1 11 11 12 1 12 11 13 1 13 11 14 1 14 14 15 1 15 9 15 1 16 1 16 1 17 1 17 1 18 1 18 1 19 3 19 1 20 3 20 1 21 3 21 1 22 4 22 1 23 4 23 1 24 4 24 1 25 5 25 1 26 5 26 1 27 6 27 1 28 6 28 1 29 7 29 1 30 8 30 1 31 13 31 1 32 13 32 1 33 13 33 1 34 14 34 1 35 14 35 1 36 15 36 1 37 15 37 1