@MOLECULE hexanoyl (1R,2R)-2-methylcyclopropanecarboxylate 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.4258 0.0811 0.2169 C.3 1 UNL11111111 0.0371 2 H 4.4983 -1.0013 0.4061 H 1 UNL11111111 0.2046 3 C 5.2803 0.8983 1.1431 C.3 1 UNL11111111 -0.8616 4 C 4.1987 0.5317 -1.2026 C.3 1 UNL11111111 -0.5661 5 C 3.0614 0.6292 -0.2021 C.3 1 UNL11111111 -0.2427 6 H 2.7504 1.6185 0.1566 H 1 UNL11111111 0.2415 7 C 1.9555 -0.3423 -0.3289 C.2 1 UNL11111111 0.3662 8 O 1.9959 -1.4881 -0.6697 O.2 1 UNL11111111 -0.2632 9 O 0.7669 0.2968 -0.0557 O.3 1 UNL11111111 -0.4180 10 C -0.3825 -0.3896 0.2884 C.2 1 UNL11111111 0.4187 11 O -0.3474 -1.4739 0.7845 O.2 1 UNL11111111 -0.2615 12 C -1.5529 0.5005 0.0090 C.3 1 UNL11111111 -0.3732 13 C -2.8542 -0.3001 0.1091 C.3 1 UNL11111111 -0.3842 14 C -4.0672 0.6186 -0.0722 C.3 1 UNL11111111 -0.3236 15 C -5.3704 -0.1871 0.0191 C.3 1 UNL11111111 -0.1053 16 C -6.5875 0.7269 -0.1202 C.3 1 UNL11111111 -0.8216 17 H 5.1915 1.9772 0.9633 H 1 UNL11111111 0.2555 18 H 5.0099 0.7208 2.1942 H 1 UNL11111111 0.2664 19 H 6.3427 0.6380 1.0301 H 1 UNL11111111 0.2697 20 H 4.6576 1.4453 -1.5710 H 1 UNL11111111 0.2398 21 H 4.1463 -0.2098 -2.0000 H 1 UNL11111111 0.2388 22 H -1.5511 1.3494 0.7272 H 1 UNL11111111 0.2138 23 H -1.4521 0.9685 -0.9942 H 1 UNL11111111 0.1997 24 H -2.8650 -1.1051 -0.6526 H 1 UNL11111111 0.1824 25 H -2.9088 -0.8214 1.0866 H 1 UNL11111111 0.2057 26 H -4.0634 1.4161 0.6940 H 1 UNL11111111 0.1633 27 H -4.0142 1.1362 -1.0482 H 1 UNL11111111 0.1508 28 H -5.3907 -0.9645 -0.7686 H 1 UNL11111111 0.1304 29 H -5.4149 -0.7303 0.9824 H 1 UNL11111111 0.1446 30 H -6.5858 1.2538 -1.0808 H 1 UNL11111111 0.2181 31 H -7.5216 0.1568 -0.0609 H 1 UNL11111111 0.2366 32 H -6.6148 1.4834 0.6719 H 1 UNL11111111 0.2375 @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 14 15 1 16 15 16 1 17 3 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 12 22 1 23 12 23 1 24 13 24 1 25 13 25 1 26 14 26 1 27 14 27 1 28 15 28 1 29 15 29 1 30 16 30 1 31 16 31 1 32 16 32 1