@MOLECULE [(2S)-2-methylbutanoyl] (1S)-2,2-dimethylcyclopropanecarboxylate 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.2600 -0.2944 -0.0726 C.3 1 UNL1111111 0.1125 2 C -3.9557 -1.6185 -0.2600 C.3 1 UNL1111111 -0.4518 3 C -3.2900 0.5708 -1.3029 C.3 1 UNL1111111 -0.4621 4 C -3.2893 0.3584 1.2884 C.3 1 UNL1111111 -0.3161 5 C -2.0042 -0.2950 0.8200 C.3 1 UNL1111111 -0.3167 6 H -1.6952 -1.2475 1.2717 H 1 UNL1111111 0.1929 7 C -0.8716 0.5716 0.4506 C.2 1 UNL1111111 0.6642 8 O -0.8473 1.7443 0.2143 O.2 1 UNL1111111 -0.4462 9 O 0.2979 -0.1663 0.4868 O.3 1 UNL1111111 -0.5532 10 C 1.3444 0.1050 -0.3649 C.2 1 UNL1111111 0.6288 11 O 1.1700 0.6418 -1.4179 O.2 1 UNL1111111 -0.4478 12 C 2.6150 -0.4610 0.2216 C.3 1 UNL1111111 -0.1524 13 H 2.5202 -0.5311 1.3356 H 1 UNL1111111 0.1730 14 C 2.8053 -1.8614 -0.3616 C.3 1 UNL1111111 -0.4384 15 C 3.7676 0.4916 -0.1387 C.3 1 UNL1111111 -0.2530 16 C 5.0261 0.1762 0.6653 C.3 1 UNL1111111 -0.4351 17 H -3.4919 -2.1985 -1.0700 H 1 UNL1111111 0.1585 18 H -3.9321 -2.2422 0.6414 H 1 UNL1111111 0.1498 19 H -5.0124 -1.4738 -0.5235 H 1 UNL1111111 0.1571 20 H -4.3185 0.7385 -1.6477 H 1 UNL1111111 0.1573 21 H -2.8442 1.5643 -1.1344 H 1 UNL1111111 0.1760 22 H -2.7329 0.1127 -2.1321 H 1 UNL1111111 0.1616 23 H -3.3345 1.4455 1.3626 H 1 UNL1111111 0.1768 24 H -3.8464 -0.0926 2.1043 H 1 UNL1111111 0.1619 25 H 3.7223 -2.3257 0.0207 H 1 UNL1111111 0.1536 26 H 1.9694 -2.5229 -0.0988 H 1 UNL1111111 0.1545 27 H 2.8826 -1.8402 -1.4567 H 1 UNL1111111 0.1575 28 H 3.9790 0.4361 -1.2257 H 1 UNL1111111 0.1539 29 H 3.4603 1.5421 0.0450 H 1 UNL1111111 0.1503 30 H 4.8494 0.2566 1.7441 H 1 UNL1111111 0.1442 31 H 5.3937 -0.8362 0.4646 H 1 UNL1111111 0.1428 32 H 5.8364 0.8715 0.4149 H 1 UNL1111111 0.1456 @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 12 14 1 15 12 15 1 16 15 16 1 17 2 17 1 18 2 18 1 19 2 19 1 20 3 20 1 21 3 21 1 22 3 22 1 23 4 23 1 24 4 24 1 25 14 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