@MOLECULE n-[(3s)-2-oxotetrahydro-3-furanyl]octanamide 37 37 0 0 0 SMALL USER_CHARGES @ATOM 1 O -5.4601 0.3194 0.2736 O.3 1 UNL11111111 -0.3820 2 O -0.7543 -1.0471 -1.1215 O.2 1 UNL11111111 -0.5224 3 O -4.2148 2.0153 -0.4434 O.2 1 UNL11111111 -0.4194 4 N -1.9619 0.2314 0.2894 N.am 1 UNL11111111 -0.6218 5 C -3.2089 -0.2343 -0.2919 C.3 1 UNL11111111 0.0041 6 C 3.0005 0.3336 0.3929 C.3 1 UNL11111111 -0.2732 7 C 1.7310 -0.2273 -0.2557 C.3 1 UNL11111111 -0.2493 8 C -3.8272 -1.4317 0.4637 C.3 1 UNL11111111 -0.3500 9 C 4.2485 -0.2479 -0.2836 C.3 1 UNL11111111 -0.2718 10 C 0.4800 0.3577 0.4093 C.3 1 UNL11111111 -0.3613 11 C 5.5240 0.3061 0.3631 C.3 1 UNL11111111 -0.2752 12 C -5.3104 -1.0697 0.5956 C.3 1 UNL11111111 -0.0369 13 C -0.7551 -0.2262 -0.2307 C.2 1 UNL11111111 0.5981 14 C -4.2898 0.8494 -0.1909 C.2 1 UNL11111111 0.5439 15 C 6.7728 -0.2792 -0.3098 C.3 1 UNL11111111 -0.2505 16 C 8.0467 0.2682 0.3341 C.3 1 UNL11111111 -0.4403 17 H -3.0457 -0.4987 -1.3772 H 1 UNL11111111 0.1985 18 H 3.0141 0.0990 1.4737 H 1 UNL11111111 0.1352 19 H 3.0128 1.4372 0.3195 H 1 UNL11111111 0.1375 20 H -3.6711 -2.3767 -0.0835 H 1 UNL11111111 0.1700 21 H -3.3469 -1.5783 1.4473 H 1 UNL11111111 0.1668 22 H 1.7191 -0.0090 -1.3427 H 1 UNL11111111 0.1558 23 H 1.7151 -1.3325 -0.1873 H 1 UNL11111111 0.1533 24 H 4.2388 -0.0121 -1.3644 H 1 UNL11111111 0.1400 25 H 4.2379 -1.3519 -0.2144 H 1 UNL11111111 0.1387 26 H 0.4794 1.4632 0.3113 H 1 UNL11111111 0.1712 27 H 0.4892 0.1426 1.4969 H 1 UNL11111111 0.1655 28 H 5.5387 1.4095 0.2907 H 1 UNL11111111 0.1363 29 H 5.5345 0.0741 1.4441 H 1 UNL11111111 0.1353 30 H -5.7024 -1.1661 1.6215 H 1 UNL11111111 0.1456 31 H -5.9613 -1.6134 -0.1105 H 1 UNL11111111 0.1442 32 H -2.0106 0.9361 1.0049 H 1 UNL11111111 0.3190 33 H 6.7583 -1.3832 -0.2395 H 1 UNL11111111 0.1343 34 H 6.7651 -0.0443 -1.3910 H 1 UNL11111111 0.1350 35 H 8.0954 0.0204 1.4002 H 1 UNL11111111 0.1420 36 H 8.1034 1.3589 0.2461 H 1 UNL11111111 0.1426 37 H 8.9419 -0.1474 -0.1416 H 1 UNL11111111 0.1413 @BOND 1 34 15 1 2 17 5 1 3 24 9 1 4 22 7 1 5 2 13 2 6 3 14 2 7 15 33 1 8 15 16 1 9 15 11 1 10 5 14 1 11 5 4 1 12 5 8 1 13 9 25 1 14 9 11 1 15 9 6 1 16 7 23 1 17 7 6 1 18 7 10 1 19 13 4 am 20 13 10 1 21 14 1 1 22 37 16 1 23 31 12 1 24 20 8 1 25 36 16 1 26 1 12 1 27 4 32 1 28 28 11 1 29 26 10 1 30 19 6 1 31 16 35 1 32 11 29 1 33 6 18 1 34 10 27 1 35 8 12 1 36 8 21 1 37 12 30 1