@MOLECULE (2R)-2-[(Z)-4,4-dimethylhex-1-enyl]-1,1-dimethyl-cyclobutane 40 40 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.3071 1.3590 -0.3815 C.3 1 UNL111 -0.4338 2 C 3.0537 0.7000 -0.9559 C.3 1 UNL111 -0.2790 3 C 2.3187 -0.2374 0.0366 C.3 1 UNL111 0.1209 4 C 3.2380 -1.3933 0.4537 C.3 1 UNL111 -0.4631 5 C 1.8699 0.5460 1.2772 C.3 1 UNL111 -0.4621 6 C 1.0721 -0.7886 -0.7095 C.3 1 UNL111 -0.3141 7 C 0.1821 -1.6202 0.1537 C.2 1 UNL111 -0.1518 8 C -1.1521 -1.5282 0.1923 C.2 1 UNL111 -0.1802 9 C -1.9559 -0.5655 -0.5977 C.3 1 UNL111 -0.1444 10 H -1.4828 -0.3511 -1.5741 H 1 UNL111 0.1436 11 C -2.3587 0.7624 0.1577 C.3 1 UNL111 0.1049 12 C -1.9843 0.8007 1.6290 C.3 1 UNL111 -0.4626 13 C -1.8797 2.0159 -0.5567 C.3 1 UNL111 -0.4669 14 C -3.8635 0.4220 -0.0891 C.3 1 UNL111 -0.3109 15 C -3.4654 -0.9125 -0.7632 C.3 1 UNL111 -0.2861 16 H 4.7723 2.0223 -1.1194 H 1 UNL111 0.1368 17 H 4.0777 1.9632 0.5030 H 1 UNL111 0.1435 18 H 5.0583 0.6168 -0.0909 H 1 UNL111 0.1414 19 H 2.3539 1.4877 -1.2962 H 1 UNL111 0.1344 20 H 3.3265 0.1243 -1.8609 H 1 UNL111 0.1338 21 H 4.1316 -1.0254 0.9685 H 1 UNL111 0.1446 22 H 2.7338 -2.0804 1.1409 H 1 UNL111 0.1445 23 H 3.5699 -1.9730 -0.4129 H 1 UNL111 0.1426 24 H 1.2798 1.4257 0.9995 H 1 UNL111 0.1435 25 H 1.2498 -0.0752 1.9340 H 1 UNL111 0.1484 26 H 2.7257 0.8899 1.8666 H 1 UNL111 0.1441 27 H 0.5143 0.0664 -1.1429 H 1 UNL111 0.1477 28 H 1.4020 -1.3993 -1.5763 H 1 UNL111 0.1496 29 H 0.7040 -2.3546 0.7684 H 1 UNL111 0.1430 30 H -1.7317 -2.1819 0.8447 H 1 UNL111 0.1437 31 H -0.8941 0.8183 1.7580 H 1 UNL111 0.1541 32 H -2.3965 1.6876 2.1221 H 1 UNL111 0.1444 33 H -2.3567 -0.0793 2.1666 H 1 UNL111 0.1487 34 H -2.1633 2.0161 -1.6148 H 1 UNL111 0.1460 35 H -2.3066 2.9182 -0.1037 H 1 UNL111 0.1483 36 H -0.7876 2.1052 -0.5060 H 1 UNL111 0.1484 37 H -4.4574 0.3129 0.8196 H 1 UNL111 0.1401 38 H -4.3814 1.1242 -0.7448 H 1 UNL111 0.1390 39 H -3.7889 -1.0149 -1.8007 H 1 UNL111 0.1358 40 H -3.7879 -1.8044 -0.2215 H 1 UNL111 0.1394 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 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 2 19 1 20 2 20 1 21 4 21 1 22 4 22 1 23 4 23 1 24 5 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 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