@MOLECULE [(1S,2S)-2-methylcyclobutyl] 2,2-dimethylpropanoate 30 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.4679 -0.0406 0.6172 C.3 1 UNL111111 -1.0122 2 C 2.2331 -0.1311 -0.2828 C.3 1 UNL111111 0.8687 3 C 2.2738 0.9542 -1.3625 C.3 1 UNL111111 -1.0200 4 C 2.1257 -1.5227 -0.9129 C.3 1 UNL111111 -1.0815 5 C 1.0005 0.1044 0.5814 C.2 1 UNL111111 0.0915 6 O 0.9617 0.3584 1.7563 O.2 1 UNL111111 -0.3276 7 O -0.1193 -0.0160 -0.1752 O.3 1 UNL111111 -0.2570 8 C -1.3739 0.1772 0.4520 C.3 1 UNL111111 0.0415 9 H -1.3349 -0.0519 1.5237 H 1 UNL111111 0.1610 10 C -2.4349 -0.5787 -0.4063 C.3 1 UNL111111 0.1098 11 H -1.9814 -1.0608 -1.2914 H 1 UNL111111 0.1540 12 C -3.2930 -1.5525 0.3691 C.3 1 UNL111111 -1.0027 13 C -3.1005 0.7902 -0.7461 C.3 1 UNL111111 -0.4441 14 C -1.9961 1.5378 0.0460 C.3 1 UNL111111 -0.3926 15 H 3.5329 0.9371 1.1130 H 1 UNL111111 0.2734 16 H 3.4397 -0.7934 1.4157 H 1 UNL111111 0.2672 17 H 4.3896 -0.1905 0.0460 H 1 UNL111111 0.2732 18 H 3.1521 0.8350 -2.0075 H 1 UNL111111 0.2653 19 H 1.3839 0.9144 -2.0048 H 1 UNL111111 0.2918 20 H 2.3202 1.9588 -0.9259 H 1 UNL111111 0.2806 21 H 2.0694 -2.3093 -0.1513 H 1 UNL111111 0.2904 22 H 1.2292 -1.6104 -1.5414 H 1 UNL111111 0.2966 23 H 2.9946 -1.7377 -1.5453 H 1 UNL111111 0.2884 24 H -3.7635 -1.0841 1.2425 H 1 UNL111111 0.3014 25 H -4.0983 -1.9573 -0.2564 H 1 UNL111111 0.2754 26 H -2.7009 -2.4025 0.7327 H 1 UNL111111 0.2703 27 H -3.1295 1.0216 -1.8125 H 1 UNL111111 0.1739 28 H -4.1078 0.9148 -0.3438 H 1 UNL111111 0.2023 29 H -2.3520 2.1442 0.8808 H 1 UNL111111 0.1735 30 H -1.3386 2.1573 -0.5706 H 1 UNL111111 0.1875 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 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 3 18 1 19 3 19 1 20 3 20 1 21 4 21 1 22 4 22 1 23 4 23 1 24 12 24 1 25 12 25 1 26 12 26 1 27 13 27 1 28 13 28 1 29 14 29 1 30 14 30 1