@MOLECULE [2-[(1R,2S)-2-methylcyclobutyl]acetyl] (1R,2R)-2-methylcyclobutanecarboxylate 36 37 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.2844 0.1413 0.0913 C.3 1 UNL11111111 -0.0669 2 H -4.3121 0.9066 -0.7090 H 1 UNL11111111 0.1600 3 C -5.1221 0.5681 1.2765 C.3 1 UNL11111111 -0.4550 4 C -4.5699 -1.2942 -0.4422 C.3 1 UNL11111111 -0.2946 5 C -3.1093 -1.7075 -0.1310 C.3 1 UNL11111111 -0.2553 6 C -2.8271 -0.2954 0.4551 C.3 1 UNL11111111 -0.2260 7 H -2.6189 -0.3026 1.5403 H 1 UNL11111111 0.1758 8 C -1.7709 0.4559 -0.2865 C.2 1 UNL11111111 0.6255 9 O -1.8872 1.3129 -1.1088 O.2 1 UNL11111111 -0.4252 10 O -0.5517 -0.0401 0.1179 O.3 1 UNL11111111 -0.5562 11 C 0.6684 0.4742 -0.2721 C.2 1 UNL11111111 0.6321 12 O 0.7840 1.5037 -0.8611 O.2 1 UNL11111111 -0.4147 13 C 1.7182 -0.4787 0.2154 C.3 1 UNL11111111 -0.3618 14 C 3.0988 -0.0080 -0.2070 C.3 1 UNL11111111 -0.1126 15 H 3.1456 0.1395 -1.3008 H 1 UNL11111111 0.1540 16 C 4.2696 -0.8903 0.3421 C.3 1 UNL11111111 -0.0960 17 H 3.9288 -1.6730 1.0399 H 1 UNL11111111 0.1314 18 C 5.1678 -1.4785 -0.7258 C.3 1 UNL11111111 -0.4531 19 C 4.8475 0.3543 1.0797 C.3 1 UNL11111111 -0.2951 20 C 3.6586 1.2115 0.5803 C.3 1 UNL11111111 -0.2774 21 H -5.1084 -0.1741 2.0833 H 1 UNL11111111 0.1467 22 H -4.7655 1.5178 1.6964 H 1 UNL11111111 0.1534 23 H -6.1708 0.7135 0.9865 H 1 UNL11111111 0.1517 24 H -5.3265 -1.8453 0.1203 H 1 UNL11111111 0.1434 25 H -4.8403 -1.3349 -1.5000 H 1 UNL11111111 0.1456 26 H -3.0060 -2.5195 0.5933 H 1 UNL11111111 0.1450 27 H -2.5122 -1.9650 -1.0109 H 1 UNL11111111 0.1491 28 H 1.6468 -0.5809 1.3208 H 1 UNL11111111 0.1831 29 H 1.5163 -1.4990 -0.1797 H 1 UNL11111111 0.1813 30 H 5.5196 -0.7153 -1.4314 H 1 UNL11111111 0.1512 31 H 6.0565 -1.9457 -0.2842 H 1 UNL11111111 0.1452 32 H 4.6461 -2.2469 -1.3088 H 1 UNL11111111 0.1462 33 H 4.9110 0.2472 2.1636 H 1 UNL11111111 0.1358 34 H 5.8240 0.6816 0.7163 H 1 UNL11111111 0.1419 35 H 3.9366 2.0591 -0.0524 H 1 UNL11111111 0.1489 36 H 3.0036 1.5886 1.3684 H 1 UNL11111111 0.1424 @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 2 13 11 13 1 14 13 14 1 15 14 15 1 16 14 16 1 17 16 17 1 18 16 18 1 19 16 19 1 20 19 20 1 21 14 20 1 22 3 21 1 23 3 22 1 24 3 23 1 25 4 24 1 26 4 25 1 27 5 26 1 28 5 27 1 29 13 28 1 30 13 29 1 31 18 30 1 32 18 31 1 33 18 32 1 34 19 33 1 35 19 34 1 36 20 35 1 37 20 36 1