@MOLECULE butanoyl (1S,2S)-2-methylcyclopropanecarboxylate 26 26 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.4709 0.0313 -0.1721 C.3 1 UNL11111111 -0.0792 2 H 3.5717 -1.0491 -0.3601 H 1 UNL11111111 0.1731 3 C 4.3881 0.8646 -1.0208 C.3 1 UNL11111111 -0.4408 4 C 3.1237 0.4710 1.2269 C.3 1 UNL11111111 -0.2999 5 C 2.0716 0.5604 0.1364 C.3 1 UNL11111111 -0.2907 6 H 1.7789 1.5491 -0.2394 H 1 UNL11111111 0.1926 7 C 0.9654 -0.4212 0.1758 C.2 1 UNL11111111 0.6453 8 O 1.0148 -1.5995 0.3699 O.2 1 UNL11111111 -0.4333 9 O -0.2168 0.2602 -0.0009 O.3 1 UNL11111111 -0.5497 10 C -1.4364 -0.3583 -0.1945 C.2 1 UNL11111111 0.6305 11 O -1.5396 -1.5036 -0.5095 O.2 1 UNL11111111 -0.4207 12 C -2.5001 0.6756 0.0125 C.3 1 UNL11111111 -0.3477 13 C -3.8851 0.0246 -0.0544 C.3 1 UNL11111111 -0.2336 14 C -4.9813 1.0747 0.1043 C.3 1 UNL11111111 -0.4399 15 H 5.4409 0.6162 -0.8237 H 1 UNL11111111 0.1563 16 H 4.2055 0.6911 -2.0911 H 1 UNL11111111 0.1573 17 H 4.2714 1.9410 -0.8425 H 1 UNL11111111 0.1495 18 H 3.0177 -0.2748 2.0141 H 1 UNL11111111 0.1715 19 H 3.5394 1.3882 1.6354 H 1 UNL11111111 0.1630 20 H -2.3511 1.1892 0.9867 H 1 UNL11111111 0.1797 21 H -2.3996 1.4750 -0.7532 H 1 UNL11111111 0.1799 22 H -4.0064 -0.5167 -1.0150 H 1 UNL11111111 0.1528 23 H -3.9795 -0.7521 0.7314 H 1 UNL11111111 0.1502 24 H -4.9067 1.5972 1.0647 H 1 UNL11111111 0.1437 25 H -4.9373 1.8301 -0.6885 H 1 UNL11111111 0.1433 26 H -5.9765 0.6155 0.0605 H 1 UNL11111111 0.1469 @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 3 15 1 16 3 16 1 17 3 17 1 18 4 18 1 19 4 19 1 20 12 20 1 21 12 21 1 22 13 22 1 23 13 23 1 24 14 24 1 25 14 25 1 26 14 26 1