@MOLECULE (2-cyclopentylacetyl) (1R)-2,2-dimethylcyclobutanecarboxylate 39 40 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.5002 0.6621 -0.1298 C.3 1 UNL11111111 0.1323 2 C -2.8935 0.7866 -1.5140 C.3 1 UNL11111111 -0.4799 3 C -3.7919 2.0254 0.4708 C.3 1 UNL11111111 -0.4679 4 C -4.6970 -0.3400 -0.0587 C.3 1 UNL11111111 -0.3062 5 C -3.8788 -1.2720 0.8674 C.3 1 UNL11111111 -0.2625 6 C -2.6937 -0.2724 0.8563 C.3 1 UNL11111111 -0.2503 7 H -2.5014 0.2047 1.8352 H 1 UNL11111111 0.1772 8 C -1.4377 -0.8198 0.2781 C.2 1 UNL11111111 0.6469 9 O -1.2272 -1.8677 -0.2545 O.2 1 UNL11111111 -0.4359 10 O -0.4100 0.0758 0.5242 O.3 1 UNL11111111 -0.5594 11 C 0.6730 0.1947 -0.3153 C.2 1 UNL11111111 0.6479 12 O 0.6145 -0.1273 -1.4651 O.2 1 UNL11111111 -0.4484 13 C 1.7872 0.8595 0.4305 C.3 1 UNL11111111 -0.3696 14 C 3.1344 0.4913 -0.1990 C.3 1 UNL11111111 -0.0783 15 C 4.2958 1.2761 0.4428 C.3 1 UNL11111111 -0.2786 16 C 5.5375 0.3761 0.2989 C.3 1 UNL11111111 -0.2631 17 C 5.0341 -1.0417 -0.0426 C.3 1 UNL11111111 -0.2594 18 C 3.4982 -0.9916 0.0090 C.3 1 UNL11111111 -0.2790 19 H -1.9360 1.3239 -1.4918 H 1 UNL11111111 0.1600 20 H -2.6975 -0.1938 -1.9724 H 1 UNL11111111 0.1667 21 H -3.5595 1.3306 -2.1944 H 1 UNL11111111 0.1548 22 H -4.4729 2.6024 -0.1669 H 1 UNL11111111 0.1527 23 H -4.2586 1.9499 1.4596 H 1 UNL11111111 0.1480 24 H -2.8732 2.6145 0.5853 H 1 UNL11111111 0.1541 25 H -5.6031 0.0696 0.3909 H 1 UNL11111111 0.1427 26 H -4.9703 -0.7828 -1.0197 H 1 UNL11111111 0.1500 27 H -4.3160 -1.4390 1.8548 H 1 UNL11111111 0.1429 28 H -3.6471 -2.2514 0.4298 H 1 UNL11111111 0.1633 29 H 1.6340 1.9604 0.4074 H 1 UNL11111111 0.1787 30 H 1.7623 0.5834 1.5067 H 1 UNL11111111 0.1832 31 H 3.1006 0.7079 -1.2944 H 1 UNL11111111 0.1531 32 H 4.4423 2.2523 -0.0427 H 1 UNL11111111 0.1325 33 H 4.0938 1.4833 1.5067 H 1 UNL11111111 0.1349 34 H 6.2049 0.7523 -0.4931 H 1 UNL11111111 0.1316 35 H 6.1323 0.3746 1.2253 H 1 UNL11111111 0.1299 36 H 5.3804 -1.3448 -1.0451 H 1 UNL11111111 0.1354 37 H 5.4330 -1.7902 0.6591 H 1 UNL11111111 0.1320 38 H 3.1286 -1.3604 0.9802 H 1 UNL11111111 0.1382 39 H 3.0368 -1.6321 -0.7606 H 1 UNL11111111 0.1494 @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 15 16 1 17 16 17 1 18 17 18 1 19 14 18 1 20 2 19 1 21 2 20 1 22 2 21 1 23 3 22 1 24 3 23 1 25 3 24 1 26 4 25 1 27 4 26 1 28 5 27 1 29 5 28 1 30 13 29 1 31 13 30 1 32 14 31 1 33 15 32 1 34 15 33 1 35 16 34 1 36 16 35 1 37 17 36 1 38 17 37 1 39 18 38 1 40 18 39 1