@MOLECULE 1,1-dimethylpropyl (1R,2S)-2-methylcyclobutanecarboxylate 33 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.5429 -0.0212 -0.9821 C.3 1 UNL111111111 -0.0583 2 H -2.7137 0.3766 -1.9983 H 1 UNL111111111 0.1366 3 C -2.2757 -1.5097 -1.0298 C.3 1 UNL111111111 -0.4655 4 C -3.6437 0.4164 0.0300 C.3 1 UNL111111111 -0.2897 5 C -2.6047 1.2643 0.8056 C.3 1 UNL111111111 -0.2584 6 C -1.4964 0.8461 -0.1979 C.3 1 UNL111111111 -0.2329 7 H -1.0979 1.6818 -0.8008 H 1 UNL111111111 0.1692 8 C -0.3906 0.0578 0.4308 C.2 1 UNL111111111 0.6309 9 O -0.4583 -0.6540 1.4008 O.2 1 UNL111111111 -0.5324 10 O 0.7443 0.2723 -0.2673 O.3 1 UNL111111111 -0.4756 11 C 1.9706 -0.3985 0.0771 C.3 1 UNL111111111 0.3480 12 C 2.3539 -0.0891 1.5192 C.3 1 UNL111111111 -0.5035 13 C 1.7878 -1.8984 -0.1585 C.3 1 UNL111111111 -0.5122 14 C 2.9574 0.1978 -0.9510 C.3 1 UNL111111111 -0.2903 15 C 3.1342 1.7056 -0.7931 C.3 1 UNL111111111 -0.4273 16 H -3.1187 -2.0505 -1.4762 H 1 UNL111111111 0.1503 17 H -1.3820 -1.7395 -1.6230 H 1 UNL111111111 0.1503 18 H -2.1166 -1.9303 -0.0252 H 1 UNL111111111 0.1682 19 H -4.4628 0.9861 -0.4116 H 1 UNL111111111 0.1370 20 H -4.0748 -0.4038 0.6103 H 1 UNL111111111 0.1490 21 H -2.8092 2.3368 0.8281 H 1 UNL111111111 0.1409 22 H -2.4293 0.9253 1.8340 H 1 UNL111111111 0.1611 23 H 1.7156 -0.6339 2.2311 H 1 UNL111111111 0.1788 24 H 3.3922 -0.3665 1.7251 H 1 UNL111111111 0.1531 25 H 2.2365 0.9777 1.7426 H 1 UNL111111111 0.1598 26 H 1.4292 -2.1033 -1.1729 H 1 UNL111111111 0.1546 27 H 2.7253 -2.4430 -0.0107 H 1 UNL111111111 0.1558 28 H 1.0498 -2.3205 0.5393 H 1 UNL111111111 0.1766 29 H 3.9313 -0.3156 -0.8537 H 1 UNL111111111 0.1423 30 H 2.5891 -0.0247 -1.9726 H 1 UNL111111111 0.1493 31 H 3.7594 2.1164 -1.5931 H 1 UNL111111111 0.1374 32 H 2.1663 2.2223 -0.8324 H 1 UNL111111111 0.1553 33 H 3.6064 1.9628 0.1611 H 1 UNL111111111 0.1417 @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 11 13 1 14 11 14 1 15 14 15 1 16 3 16 1 17 3 17 1 18 3 18 1 19 4 19 1 20 4 20 1 21 5 21 1 22 5 22 1 23 12 23 1 24 12 24 1 25 12 25 1 26 13 26 1 27 13 27 1 28 13 28 1 29 14 29 1 30 14 30 1 31 15 31 1 32 15 32 1 33 15 33 1