@MOLECULE 3,3-dimethylbutyl (1R,2S)-2-methylcyclobutanecarboxylate 36 36 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.3770 -0.8376 -0.5966 C.3 1 UNL11111111 -0.0590 2 H -3.5499 -1.2950 -1.5872 H 1 UNL11111111 0.1371 3 C -2.9840 -1.8906 0.4158 C.3 1 UNL11111111 -0.4658 4 C -4.5414 0.0971 -0.1516 C.3 1 UNL11111111 -0.2900 5 C -3.6005 1.3242 -0.2414 C.3 1 UNL11111111 -0.2600 6 C -2.4314 0.4108 -0.7019 C.3 1 UNL11111111 -0.2318 7 H -2.0970 0.6035 -1.7382 H 1 UNL11111111 0.1709 8 C -1.2777 0.4058 0.2445 C.2 1 UNL11111111 0.6123 9 O -1.2825 0.5753 1.4376 O.2 1 UNL11111111 -0.5201 10 O -0.1285 0.1901 -0.4432 O.3 1 UNL11111111 -0.4447 11 C 1.0800 0.1667 0.3329 C.3 1 UNL11111111 -0.0058 12 C 2.1773 0.0036 -0.7151 C.3 1 UNL11111111 -0.3267 13 C 3.5900 -0.0725 -0.0966 C.3 1 UNL11111111 0.1348 14 C 3.7009 -1.2645 0.8657 C.3 1 UNL11111111 -0.4680 15 C 4.5995 -0.2636 -1.2441 C.3 1 UNL11111111 -0.4688 16 C 3.9218 1.2271 0.6516 C.3 1 UNL11111111 -0.4681 17 H -3.7683 -2.6500 0.5221 H 1 UNL11111111 0.1507 18 H -2.0612 -2.4072 0.1242 H 1 UNL11111111 0.1518 19 H -2.8143 -1.4589 1.4140 H 1 UNL11111111 0.1688 20 H -5.3899 0.1201 -0.8378 H 1 UNL11111111 0.1386 21 H -4.9223 -0.1049 0.8534 H 1 UNL11111111 0.1498 22 H -3.8952 2.0800 -0.9727 H 1 UNL11111111 0.1419 23 H -3.4265 1.8255 0.7185 H 1 UNL11111111 0.1611 24 H 1.1550 1.1119 0.8975 H 1 UNL11111111 0.1372 25 H 1.0190 -0.6809 1.0359 H 1 UNL11111111 0.1336 26 H 1.9795 -0.9061 -1.3155 H 1 UNL11111111 0.1540 27 H 2.1267 0.8448 -1.4344 H 1 UNL11111111 0.1536 28 H 3.4160 -2.2014 0.3760 H 1 UNL11111111 0.1458 29 H 4.7270 -1.3825 1.2307 H 1 UNL11111111 0.1458 30 H 3.0593 -1.1398 1.7441 H 1 UNL11111111 0.1470 31 H 4.5554 0.5646 -1.9582 H 1 UNL11111111 0.1446 32 H 5.6255 -0.3155 -0.8655 H 1 UNL11111111 0.1456 33 H 4.4072 -1.1897 -1.7954 H 1 UNL11111111 0.1444 34 H 3.2827 1.3644 1.5301 H 1 UNL11111111 0.1473 35 H 4.9591 1.2272 1.0032 H 1 UNL11111111 0.1460 36 H 3.7933 2.1032 0.0076 H 1 UNL11111111 0.1461 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 1 6 1 8 6 8 1 9 8 9 2 10 8 10 1 11 10 11 1 12 11 12 1 13 12 13 1 14 13 14 1 15 13 15 1 16 13 16 1 17 3 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 5 22 1 23 5 23 1 24 11 24 1 25 11 25 1 26 12 26 1 27 12 27 1 28 14 28 1 29 14 29 1 30 14 30 1 31 15 31 1 32 15 32 1 33 15 33 1 34 16 34 1 35 16 35 1 36 16 36 1