@MOLECULE (2R)-2-methyl-1-[(1R,2R)-2-methylcyclobutyl]pentan-1-one 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.7637 -0.0461 -0.3943 C.3 1 UNL11111111 -0.0667 2 H -2.5817 0.0895 -1.4783 H 1 UNL11111111 0.1603 3 C -3.8868 0.8513 0.0813 C.3 1 UNL11111111 -0.4555 4 C -2.8936 -1.5443 0.0103 C.3 1 UNL11111111 -0.2912 5 C -1.5647 -1.4499 0.8027 C.3 1 UNL11111111 -0.2635 6 C -1.4495 0.0588 0.4432 C.3 1 UNL11111111 -0.2627 7 H -1.5433 0.7278 1.3144 H 1 UNL11111111 0.1603 8 C -0.2144 0.3819 -0.3462 C.2 1 UNL11111111 0.4556 9 O -0.2337 0.5468 -1.5394 O.2 1 UNL11111111 -0.4527 10 C 1.0745 0.4991 0.4546 C.3 1 UNL11111111 -0.2012 11 H 0.9831 -0.0791 1.4048 H 1 UNL11111111 0.1506 12 C 1.2720 1.9826 0.7757 C.3 1 UNL11111111 -0.4363 13 C 2.2375 -0.0693 -0.3724 C.3 1 UNL11111111 -0.2658 14 C 3.4666 -0.3493 0.5003 C.3 1 UNL11111111 -0.2486 15 C 4.5883 -0.9732 -0.3305 C.3 1 UNL11111111 -0.4401 16 H -4.0967 0.7218 1.1491 H 1 UNL11111111 0.1446 17 H -3.6443 1.9090 -0.0825 H 1 UNL11111111 0.1498 18 H -4.8161 0.6411 -0.4627 H 1 UNL11111111 0.1491 19 H -3.7693 -1.7750 0.6200 H 1 UNL11111111 0.1409 20 H -2.8720 -2.2396 -0.8318 H 1 UNL11111111 0.1429 21 H -1.6567 -1.6493 1.8726 H 1 UNL11111111 0.1403 22 H -0.7602 -2.0763 0.4070 H 1 UNL11111111 0.1436 23 H 0.4710 2.3714 1.4141 H 1 UNL11111111 0.1422 24 H 2.2212 2.1507 1.2984 H 1 UNL11111111 0.1522 25 H 1.2940 2.5899 -0.1402 H 1 UNL11111111 0.1595 26 H 1.9184 -0.9999 -0.8814 H 1 UNL11111111 0.1444 27 H 2.4942 0.6307 -1.1915 H 1 UNL11111111 0.1558 28 H 3.8210 0.5872 0.9707 H 1 UNL11111111 0.1331 29 H 3.1963 -1.0247 1.3339 H 1 UNL11111111 0.1314 30 H 4.2821 -1.9336 -0.7609 H 1 UNL11111111 0.1442 31 H 4.8832 -0.3202 -1.1600 H 1 UNL11111111 0.1451 32 H 5.4801 -1.1555 0.2783 H 1 UNL11111111 0.1388 @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 10 12 1 13 10 13 1 14 13 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 14 28 1 29 14 29 1 30 15 30 1 31 15 31 1 32 15 32 1