@MOLECULE (2R)-2-[(E)-3,3-dimethylhex-1-enyl]-1,1-dimethyl-cyclobutane 40 40 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.1326 -1.2780 -0.4762 C.3 1 UNL11111111 -0.8220 2 C 4.1902 -0.1973 0.0574 C.3 1 UNL11111111 -0.0772 3 C 2.7449 -0.4883 -0.3619 C.3 1 UNL11111111 -0.5213 4 C 1.7270 0.5807 0.1094 C.3 1 UNL11111111 0.6262 5 C 1.7051 0.6716 1.6422 C.3 1 UNL11111111 -0.8857 6 C 2.0738 1.9673 -0.4649 C.3 1 UNL11111111 -0.9034 7 C 0.3895 0.1680 -0.4544 C.2 1 UNL11111111 -0.4679 8 C -0.5858 -0.4337 0.2320 C.2 1 UNL11111111 -0.2741 9 C -1.8810 -0.7946 -0.3963 C.3 1 UNL11111111 -0.1339 10 H -1.7582 -1.0276 -1.4693 H 1 UNL11111111 0.1681 11 C -3.0532 0.2369 -0.1509 C.3 1 UNL11111111 0.6278 12 C -2.6982 1.4129 0.7415 C.3 1 UNL11111111 -1.0765 13 C -3.6976 0.7118 -1.4437 C.3 1 UNL11111111 -1.0581 14 C -3.8608 -0.8847 0.5772 C.3 1 UNL11111111 -0.5105 15 C -2.7030 -1.8855 0.3506 C.3 1 UNL11111111 -0.4119 16 H 6.1668 -1.0880 -0.1698 H 1 UNL11111111 0.2230 17 H 4.8548 -2.2703 -0.1039 H 1 UNL11111111 0.2395 18 H 5.1149 -1.3194 -1.5708 H 1 UNL11111111 0.2386 19 H 4.2648 -0.1442 1.1596 H 1 UNL11111111 0.1245 20 H 4.5058 0.7943 -0.3180 H 1 UNL11111111 0.1235 21 H 2.6923 -0.5788 -1.4633 H 1 UNL11111111 0.1932 22 H 2.4355 -1.4745 0.0342 H 1 UNL11111111 0.1927 23 H 2.6384 1.0922 2.0304 H 1 UNL11111111 0.2324 24 H 0.8879 1.3152 1.9863 H 1 UNL11111111 0.2397 25 H 1.5754 -0.3140 2.1013 H 1 UNL11111111 0.2384 26 H 2.2245 1.9267 -1.5481 H 1 UNL11111111 0.2388 27 H 1.2705 2.6847 -0.2641 H 1 UNL11111111 0.2476 28 H 2.9895 2.3679 -0.0194 H 1 UNL11111111 0.2391 29 H 0.2716 0.3958 -1.5138 H 1 UNL11111111 0.2325 30 H -0.4942 -0.6785 1.2881 H 1 UNL11111111 0.2381 31 H -1.9577 2.0642 0.2603 H 1 UNL11111111 0.3125 32 H -3.5809 2.0199 0.9706 H 1 UNL11111111 0.2765 33 H -2.2664 1.0846 1.6943 H 1 UNL11111111 0.2969 34 H -3.9690 -0.1257 -2.0961 H 1 UNL11111111 0.2775 35 H -4.6132 1.2807 -1.2447 H 1 UNL11111111 0.2845 36 H -3.0196 1.3627 -2.0084 H 1 UNL11111111 0.2810 37 H -4.0789 -0.6730 1.6256 H 1 UNL11111111 0.1949 38 H -4.7983 -1.1553 0.0885 H 1 UNL11111111 0.1918 39 H -2.9613 -2.7483 -0.2666 H 1 UNL11111111 0.1760 40 H -2.2396 -2.2557 1.2678 H 1 UNL11111111 0.1870 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 4 6 1 6 4 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 2 19 1 20 2 20 1 21 3 21 1 22 3 22 1 23 5 23 1 24 5 24 1 25 5 25 1 26 6 26 1 27 6 27 1 28 6 28 1 29 7 29 1 30 8 30 1 31 12 31 1 32 12 32 1 33 12 33 1 34 13 34 1 35 13 35 1 36 13 36 1 37 14 37 1 38 14 38 1 39 15 39 1 40 15 40 1