@MOLECULE cyclopropyl (2S)-2-methylpentanoate 27 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.8699 0.4986 -0.1172 C.3 1 UNL11111111 -0.1610 2 H 0.7808 0.8167 -1.1875 H 1 UNL11111111 0.1703 3 C 0.8733 1.7352 0.7834 C.3 1 UNL11111111 -0.4389 4 C 2.1299 -0.3613 0.0635 C.3 1 UNL11111111 -0.2711 5 C 3.3552 0.2935 -0.5845 C.3 1 UNL11111111 -0.2447 6 C 4.6072 -0.5473 -0.3348 C.3 1 UNL11111111 -0.4398 7 C -0.3328 -0.3303 0.2687 C.2 1 UNL11111111 0.5930 8 O -0.4125 -1.1954 1.0974 O.2 1 UNL11111111 -0.4954 9 O -1.3932 0.0537 -0.4984 O.3 1 UNL11111111 -0.4254 10 C -2.6307 -0.5536 -0.2251 C.3 1 UNL11111111 0.0983 11 C -3.6371 0.3322 0.4702 C.3 1 UNL11111111 -0.3549 12 C -3.7441 0.0798 -1.0197 C.3 1 UNL11111111 -0.3369 13 H 0.9461 1.4641 1.8450 H 1 UNL11111111 0.1589 14 H 1.7247 2.3878 0.5550 H 1 UNL11111111 0.1560 15 H -0.0399 2.3298 0.6526 H 1 UNL11111111 0.1539 16 H 2.3128 -0.5417 1.1418 H 1 UNL11111111 0.1576 17 H 1.9686 -1.3672 -0.3735 H 1 UNL11111111 0.1493 18 H 3.1921 0.4162 -1.6721 H 1 UNL11111111 0.1343 19 H 3.5028 1.3137 -0.1824 H 1 UNL11111111 0.1349 20 H 4.8238 -0.6361 0.7359 H 1 UNL11111111 0.1446 21 H 4.4971 -1.5622 -0.7334 H 1 UNL11111111 0.1453 22 H 5.4869 -0.1014 -0.8114 H 1 UNL11111111 0.1396 23 H -2.5476 -1.6221 -0.0382 H 1 UNL11111111 0.1672 24 H -4.3601 -0.1025 1.1530 H 1 UNL11111111 0.1640 25 H -3.3330 1.3146 0.8220 H 1 UNL11111111 0.1679 26 H -3.5122 0.8859 -1.7130 H 1 UNL11111111 0.1708 27 H -4.5447 -0.5376 -1.4152 H 1 UNL11111111 0.1622 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 7 1 7 7 8 2 8 7 9 1 9 9 10 1 10 10 11 1 11 11 12 1 12 10 12 1 13 3 13 1 14 3 14 1 15 3 15 1 16 4 16 1 17 4 17 1 18 5 18 1 19 5 19 1 20 6 20 1 21 6 21 1 22 6 22 1 23 10 23 1 24 11 24 1 25 11 25 1 26 12 26 1 27 12 27 1