@MOLECULE [(3R)-3-methylhexanoyl] (1R,2R)-2-methylcyclopropanecarboxylate 35 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.5774 0.0735 0.1034 C.3 1 UNL1111111 -0.0775 2 H 4.5953 -0.7999 0.7737 H 1 UNL1111111 0.1717 3 C 5.5296 1.1557 0.5244 C.3 1 UNL1111111 -0.4409 4 C 4.2920 -0.1691 -1.3557 C.3 1 UNL1111111 -0.2981 5 C 3.2249 0.4731 -0.4885 C.3 1 UNL1111111 -0.2933 6 H 2.9955 1.5373 -0.6266 H 1 UNL1111111 0.1932 7 C 2.0598 -0.3511 -0.1091 C.2 1 UNL1111111 0.6533 8 O 2.0059 -1.5293 0.0953 O.2 1 UNL1111111 -0.4474 9 O 0.9342 0.4396 -0.0834 O.3 1 UNL1111111 -0.5513 10 C -0.1934 0.0826 0.6346 C.2 1 UNL1111111 0.6463 11 O -0.1200 -0.5886 1.6187 O.2 1 UNL1111111 -0.4323 12 C -1.3794 0.7524 0.0181 C.3 1 UNL1111111 -0.3680 13 C -2.6222 -0.1521 0.1488 C.3 1 UNL1111111 -0.0626 14 H -2.7512 -0.4284 1.2259 H 1 UNL1111111 0.1525 15 C -2.4308 -1.4301 -0.6712 C.3 1 UNL1111111 -0.4593 16 C -3.8595 0.6332 -0.3223 C.3 1 UNL1111111 -0.2877 17 C -5.1614 -0.0646 0.0932 C.3 1 UNL1111111 -0.2458 18 C -6.3755 0.7794 -0.2948 C.3 1 UNL1111111 -0.4441 19 H 5.5314 2.0118 -0.1616 H 1 UNL1111111 0.1499 20 H 5.2760 1.5404 1.5227 H 1 UNL1111111 0.1579 21 H 6.5605 0.7773 0.5722 H 1 UNL1111111 0.1564 22 H 4.7815 0.4284 -2.1202 H 1 UNL1111111 0.1627 23 H 4.1466 -1.1890 -1.7123 H 1 UNL1111111 0.1732 24 H -1.5467 1.7267 0.5258 H 1 UNL1111111 0.1771 25 H -1.1900 1.0014 -1.0477 H 1 UNL1111111 0.1824 26 H -2.2557 -1.2153 -1.7303 H 1 UNL1111111 0.1459 27 H -1.5774 -2.0174 -0.3051 H 1 UNL1111111 0.1600 28 H -3.3115 -2.0796 -0.6090 H 1 UNL1111111 0.1494 29 H -3.8435 1.6556 0.1007 H 1 UNL1111111 0.1362 30 H -3.8345 0.7606 -1.4202 H 1 UNL1111111 0.1403 31 H -5.2289 -1.0617 -0.3822 H 1 UNL1111111 0.1366 32 H -5.1633 -0.2492 1.1844 H 1 UNL1111111 0.1370 33 H -6.3615 1.7562 0.2011 H 1 UNL1111111 0.1421 34 H -6.4121 0.9578 -1.3750 H 1 UNL1111111 0.1420 35 H -7.3104 0.2821 -0.0127 H 1 UNL1111111 0.1421 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 5 1 7 5 7 1 8 7 8 2 9 7 9 1 10 9 10 1 11 10 11 2 12 10 12 1 13 12 13 1 14 13 14 1 15 13 15 1 16 13 16 1 17 16 17 1 18 17 18 1 19 3 19 1 20 3 20 1 21 3 21 1 22 4 22 1 23 4 23 1 24 12 24 1 25 12 25 1 26 15 26 1 27 15 27 1 28 15 28 1 29 16 29 1 30 16 30 1 31 17 31 1 32 17 32 1 33 18 33 1 34 18 34 1 35 18 35 1