@MOLECULE heptanoyl (1R,2S)-2-methylcyclopropanecarboxylate 35 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.9224 -0.3393 0.6084 C.3 1 UNL11111111 -0.0733 2 H -5.4124 -0.7824 1.4871 H 1 UNL11111111 0.1553 3 C -5.1170 1.1476 0.5310 C.3 1 UNL11111111 -0.4512 4 C -4.8514 -1.1587 -0.6538 C.3 1 UNL11111111 -0.3006 5 C -3.5985 -0.9815 0.1833 C.3 1 UNL11111111 -0.2959 6 H -3.2259 -1.8319 0.7712 H 1 UNL11111111 0.1911 7 C -2.5229 -0.1261 -0.3569 C.2 1 UNL11111111 0.6620 8 O -2.5707 0.7106 -1.2108 O.2 1 UNL11111111 -0.4479 9 O -1.3285 -0.4944 0.2220 O.3 1 UNL11111111 -0.5575 10 C -0.2188 0.3315 0.2144 C.2 1 UNL11111111 0.6400 11 O -0.3188 1.5198 0.1828 O.2 1 UNL11111111 -0.4279 12 C 0.9998 -0.5290 0.3312 C.3 1 UNL11111111 -0.3466 13 C 2.2624 0.3158 0.1395 C.3 1 UNL11111111 -0.2556 14 C 3.5094 -0.5747 0.1609 C.3 1 UNL11111111 -0.2727 15 C 4.7753 0.2648 -0.0544 C.3 1 UNL11111111 -0.2696 16 C 6.0281 -0.6197 -0.0047 C.3 1 UNL11111111 -0.2550 17 C 7.2939 0.2140 -0.2008 C.3 1 UNL11111111 -0.4397 18 H -6.1835 1.4034 0.4697 H 1 UNL11111111 0.1561 19 H -4.7037 1.6551 1.4134 H 1 UNL11111111 0.1579 20 H -4.6300 1.5964 -0.3501 H 1 UNL11111111 0.1763 21 H -5.3216 -2.1365 -0.7054 H 1 UNL11111111 0.1602 22 H -4.9168 -0.6597 -1.6218 H 1 UNL11111111 0.1779 23 H 1.0067 -1.0370 1.3199 H 1 UNL11111111 0.1799 24 H 0.9567 -1.3512 -0.4166 H 1 UNL11111111 0.1810 25 H 2.2069 0.8763 -0.8156 H 1 UNL11111111 0.1548 26 H 2.3272 1.0916 0.9284 H 1 UNL11111111 0.1533 27 H 3.5754 -1.1169 1.1226 H 1 UNL11111111 0.1362 28 H 3.4375 -1.3527 -0.6225 H 1 UNL11111111 0.1375 29 H 4.7234 0.7897 -1.0269 H 1 UNL11111111 0.1402 30 H 4.8427 1.0578 0.7138 H 1 UNL11111111 0.1393 31 H 6.0762 -1.1547 0.9624 H 1 UNL11111111 0.1328 32 H 5.9690 -1.4042 -0.7826 H 1 UNL11111111 0.1334 33 H 7.3939 0.9801 0.5762 H 1 UNL11111111 0.1435 34 H 8.1918 -0.4124 -0.1620 H 1 UNL11111111 0.1407 35 H 7.2913 0.7251 -1.1701 H 1 UNL11111111 0.1439 @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 16 17 1 18 3 18 1 19 3 19 1 20 3 20 1 21 4 21 1 22 4 22 1 23 12 23 1 24 12 24 1 25 13 25 1 26 13 26 1 27 14 27 1 28 14 28 1 29 15 29 1 30 15 30 1 31 16 31 1 32 16 32 1 33 17 33 1 34 17 34 1 35 17 35 1