@MOLECULE [2-[(1S,2R)-2-methylcyclobutyl]acetyl] cyclopentanecarboxylate 36 37 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.1092 -1.3930 0.3027 C.3 1 UNL11111111 -0.4119 2 C -4.5987 -1.6957 0.0825 C.3 1 UNL11111111 -0.4215 3 C -5.2715 -0.3375 -0.1861 C.3 1 UNL11111111 -0.3285 4 C -4.1623 0.6386 -0.6226 C.3 1 UNL11111111 -0.4348 5 C -2.8319 -0.1345 -0.5436 C.3 1 UNL11111111 0.3265 6 C -1.7573 0.6918 0.1106 C.2 1 UNL11111111 0.0477 7 O -1.8564 1.6768 0.7757 O.2 1 UNL11111111 -0.2156 8 O -0.5524 0.0872 -0.1676 O.3 1 UNL11111111 -0.3708 9 C 0.6795 0.5731 0.2222 C.2 1 UNL11111111 0.5912 10 O 0.8278 1.6263 0.7591 O.2 1 UNL11111111 -0.3427 11 C 1.6924 -0.4580 -0.1765 C.3 1 UNL11111111 -0.8044 12 C 3.0899 -0.0192 0.2229 C.3 1 UNL11111111 0.1164 13 H 3.1264 0.2519 1.2932 H 1 UNL11111111 0.1588 14 C 4.2125 -1.0284 -0.1922 C.3 1 UNL11111111 0.0713 15 H 3.8355 -1.8656 -0.8027 H 1 UNL11111111 0.1406 16 C 5.0533 -1.5413 0.9580 C.3 1 UNL11111111 -0.9775 17 C 4.8783 0.0845 -1.0554 C.3 1 UNL11111111 -0.4335 18 C 3.7367 1.0639 -0.6870 C.3 1 UNL11111111 -0.4842 19 H -2.9062 -1.2063 1.3728 H 1 UNL11111111 0.2398 20 H -2.4631 -2.2335 0.0054 H 1 UNL11111111 0.1659 21 H -4.7357 -2.3745 -0.7763 H 1 UNL11111111 0.1940 22 H -5.0417 -2.2050 0.9522 H 1 UNL11111111 0.2005 23 H -6.0534 -0.4262 -0.9563 H 1 UNL11111111 0.1590 24 H -5.7765 0.0331 0.7225 H 1 UNL11111111 0.1895 25 H -4.3373 1.0177 -1.6421 H 1 UNL11111111 0.1448 26 H -4.1509 1.5296 0.0350 H 1 UNL11111111 0.1837 27 H -2.5030 -0.4357 -1.5673 H 1 UNL11111111 0.0963 28 H 1.4420 -1.4333 0.2974 H 1 UNL11111111 0.3001 29 H 1.6262 -0.6461 -1.2709 H 1 UNL11111111 0.3024 30 H 4.4739 -2.2024 1.6138 H 1 UNL11111111 0.2787 31 H 5.9169 -2.1114 0.5950 H 1 UNL11111111 0.2764 32 H 5.4424 -0.7237 1.5777 H 1 UNL11111111 0.2872 33 H 5.8672 0.3933 -0.7097 H 1 UNL11111111 0.2036 34 H 4.9527 -0.1518 -2.1180 H 1 UNL11111111 0.1627 35 H 3.1195 1.3837 -1.5291 H 1 UNL11111111 0.1975 36 H 4.0568 1.9619 -0.1514 H 1 UNL11111111 0.1909 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 1 5 1 6 5 6 1 7 6 7 2 8 6 8 1 9 8 9 1 10 9 10 2 11 9 11 1 12 11 12 1 13 12 13 1 14 12 14 1 15 14 15 1 16 14 16 1 17 14 17 1 18 17 18 1 19 12 18 1 20 1 19 1 21 1 20 1 22 2 21 1 23 2 22 1 24 3 23 1 25 3 24 1 26 4 25 1 27 4 26 1 28 5 27 1 29 11 28 1 30 11 29 1 31 16 30 1 32 16 31 1 33 16 32 1 34 17 33 1 35 17 34 1 36 18 35 1 37 18 36 1