@MOLECULE acetyl 2-[(1R,2S)-2-methylcyclobutyl]acetate 26 26 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.0615 -1.2113 -0.5126 C.3 1 UNL11111111 -0.5128 2 C 3.1716 -0.1189 -0.0239 C.2 1 UNL11111111 0.6503 3 O 3.4751 0.9271 0.4625 O.2 1 UNL11111111 -0.4242 4 O 1.8701 -0.5167 -0.2277 O.3 1 UNL11111111 -0.5568 5 C 0.7608 0.2103 0.1595 C.2 1 UNL11111111 0.6303 6 O 0.8295 1.2629 0.7132 O.2 1 UNL11111111 -0.4118 7 C -0.4418 -0.5933 -0.2340 C.3 1 UNL11111111 -0.3637 8 C -1.7178 0.1072 0.1995 C.3 1 UNL11111111 -0.1124 9 H -1.6401 0.4545 1.2459 H 1 UNL11111111 0.1571 10 C -3.0200 -0.7183 -0.0703 C.3 1 UNL11111111 -0.0958 11 H -2.8327 -1.6485 -0.6315 H 1 UNL11111111 0.1315 12 C -3.8506 -0.9951 1.1653 C.3 1 UNL11111111 -0.4532 13 C -3.5472 0.4305 -0.9806 C.3 1 UNL11111111 -0.2943 14 C -2.2336 1.2202 -0.7569 C.3 1 UNL11111111 -0.2784 15 H 5.1165 -0.8961 -0.4879 H 1 UNL11111111 0.1851 16 H 3.9612 -2.1139 0.1108 H 1 UNL11111111 0.1859 17 H 3.8151 -1.5075 -1.5442 H 1 UNL11111111 0.1862 18 H -0.4332 -0.7756 -1.3309 H 1 UNL11111111 0.1830 19 H -0.3801 -1.6063 0.2237 H 1 UNL11111111 0.1821 20 H -4.0792 -0.0764 1.7200 H 1 UNL11111111 0.1515 21 H -4.8070 -1.4636 0.9046 H 1 UNL11111111 0.1454 22 H -3.3297 -1.6707 1.8546 H 1 UNL11111111 0.1469 23 H -3.7344 0.1375 -2.0149 H 1 UNL11111111 0.1360 24 H -4.4435 0.9291 -0.6056 H 1 UNL11111111 0.1422 25 H -2.3613 2.1950 -0.2779 H 1 UNL11111111 0.1485 26 H -1.6322 1.3692 -1.6557 H 1 UNL11111111 0.1413 @BOND 1 1 2 1 2 2 3 2 3 2 4 1 4 4 5 1 5 5 6 2 6 5 7 1 7 7 8 1 8 8 9 1 9 8 10 1 10 10 11 1 11 10 12 1 12 10 13 1 13 13 14 1 14 8 14 1 15 1 15 1 16 1 16 1 17 1 17 1 18 7 18 1 19 7 19 1 20 12 20 1 21 12 21 1 22 12 22 1 23 13 23 1 24 13 24 1 25 14 25 1 26 14 26 1