@MOLECULE (4s,5s)-3-[3-(1-azepanyl)propyl]-4-isobutyl-5-phenyl-1,3-oxazolidin-2-one 60 62 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.9764 -1.2120 -1.8785 O.3 1 UNL1111111111 -0.3913 2 O 1.5665 -3.3628 -1.3404 O.2 1 UNL1111111111 -0.4673 3 N 1.9212 -1.7560 0.3284 N.am 1 UNL1111111111 -0.5220 4 N -2.3309 -1.0148 0.8235 N.3 1 UNL1111111111 -0.4415 5 C 2.0945 -0.2890 0.3217 C.3 1 UNL1111111111 0.0314 6 C 2.0347 0.0521 -1.2044 C.3 1 UNL1111111111 0.0649 7 C 3.4504 0.0615 0.9490 C.3 1 UNL1111111111 -0.3110 8 C 1.1858 -2.3994 1.4210 C.3 1 UNL1111111111 -0.0594 9 C 3.6229 1.5769 1.1461 C.3 1 UNL1111111111 -0.0574 10 C -0.1864 -1.7836 1.7315 C.3 1 UNL1111111111 -0.3219 11 C -1.1375 -1.8456 0.5222 C.3 1 UNL1111111111 -0.1151 12 C -3.4989 -1.5208 0.0586 C.3 1 UNL1111111111 -0.1033 13 C -2.0569 0.4250 0.6112 C.3 1 UNL1111111111 -0.1088 14 C 1.7670 -2.2361 -0.9768 C.2 1 UNL1111111111 0.6897 15 C -4.6536 -0.5158 -0.1047 C.3 1 UNL1111111111 -0.2797 16 C -2.7662 1.2304 1.7178 C.3 1 UNL1111111111 -0.2713 17 C 0.8214 0.8556 -1.5678 C.ar 1 UNL1111111111 -0.0612 18 C -5.0258 0.1972 1.2011 C.3 1 UNL1111111111 -0.2541 19 C -4.2368 1.5013 1.3856 C.3 1 UNL1111111111 -0.2633 20 C 2.6737 2.1070 2.2272 C.3 1 UNL1111111111 -0.4551 21 C 5.0753 1.8726 1.5417 C.3 1 UNL1111111111 -0.4553 22 C -0.1258 0.3519 -2.4585 C.ar 1 UNL1111111111 -0.1342 23 C 0.6521 2.1263 -1.0142 C.ar 1 UNL1111111111 -0.1752 24 C -1.2468 1.1136 -2.7840 C.ar 1 UNL1111111111 -0.1439 25 C -0.4683 2.8850 -1.3417 C.ar 1 UNL1111111111 -0.1352 26 C -1.4209 2.3779 -2.2249 C.ar 1 UNL1111111111 -0.1501 27 H 1.2698 0.2210 0.8777 H 1 UNL1111111111 0.1543 28 H 2.9704 0.5192 -1.5829 H 1 UNL1111111111 0.1679 29 H 4.2711 -0.3428 0.3244 H 1 UNL1111111111 0.1580 30 H 3.5522 -0.4607 1.9211 H 1 UNL1111111111 0.1573 31 H 1.8333 -2.3490 2.3283 H 1 UNL1111111111 0.1443 32 H 1.0746 -3.4834 1.1689 H 1 UNL1111111111 0.1664 33 H 3.4072 2.1006 0.1829 H 1 UNL1111111111 0.1290 34 H -0.0822 -0.7414 2.0869 H 1 UNL1111111111 0.1501 35 H -0.6506 -2.3189 2.5845 H 1 UNL1111111111 0.1628 36 H -0.6233 -1.5227 -0.4082 H 1 UNL1111111111 0.1202 37 H -1.4480 -2.9012 0.3583 H 1 UNL1111111111 0.1447 38 H -3.8657 -2.4046 0.6333 H 1 UNL1111111111 0.1400 39 H -3.2086 -1.8846 -0.9530 H 1 UNL1111111111 0.1123 40 H -2.3707 0.7811 -0.3921 H 1 UNL1111111111 0.1292 41 H -0.9642 0.6218 0.6674 H 1 UNL1111111111 0.1227 42 H -5.5342 -1.0649 -0.4920 H 1 UNL1111111111 0.1324 43 H -4.4037 0.2277 -0.8844 H 1 UNL1111111111 0.1377 44 H -2.2335 2.1847 1.8755 H 1 UNL1111111111 0.1232 45 H -2.6959 0.6687 2.6713 H 1 UNL1111111111 0.1549 46 H -6.1091 0.4163 1.2122 H 1 UNL1111111111 0.1233 47 H -4.8378 -0.4759 2.0617 H 1 UNL1111111111 0.1520 48 H -4.6931 2.0963 2.1998 H 1 UNL1111111111 0.1275 49 H -4.3139 2.1251 0.4765 H 1 UNL1111111111 0.1298 50 H 2.8350 1.5977 3.1837 H 1 UNL1111111111 0.1466 51 H 1.6212 1.9715 1.9568 H 1 UNL1111111111 0.1431 52 H 2.8296 3.1780 2.3993 H 1 UNL1111111111 0.1441 53 H 5.2316 2.9439 1.7088 H 1 UNL1111111111 0.1429 54 H 5.3543 1.3546 2.4656 H 1 UNL1111111111 0.1447 55 H 5.7776 1.5577 0.7620 H 1 UNL1111111111 0.1454 56 H 0.0120 -0.6342 -2.9090 H 1 UNL1111111111 0.1767 57 H 1.3948 2.5308 -0.3279 H 1 UNL1111111111 0.1548 58 H -1.9854 0.7186 -3.4799 H 1 UNL1111111111 0.1542 59 H -0.5984 3.8752 -0.9091 H 1 UNL1111111111 0.1502 60 H -2.2973 2.9700 -2.4782 H 1 UNL1111111111 0.1491 @BOND 1 1 6 1 2 1 14 1 3 2 14 2 4 3 5 1 5 3 8 1 6 3 14 am 7 4 11 1 8 4 12 1 9 4 13 1 10 5 6 1 11 5 7 1 12 5 27 1 13 6 17 1 14 6 28 1 15 7 9 1 16 7 29 1 17 7 30 1 18 8 10 1 19 8 31 1 20 8 32 1 21 9 20 1 22 9 21 1 23 9 33 1 24 10 11 1 25 10 34 1 26 10 35 1 27 11 36 1 28 11 37 1 29 12 15 1 30 12 38 1 31 12 39 1 32 13 16 1 33 13 40 1 34 13 41 1 35 15 18 1 36 15 42 1 37 15 43 1 38 16 19 1 39 16 44 1 40 16 45 1 41 17 22 ar 42 17 23 ar 43 18 19 1 44 18 46 1 45 18 47 1 46 19 48 1 47 19 49 1 48 20 50 1 49 20 51 1 50 20 52 1 51 21 53 1 52 21 54 1 53 21 55 1 54 22 24 ar 55 22 56 1 56 23 25 ar 57 23 57 1 58 24 26 ar 59 24 58 1 60 25 26 ar 61 25 59 1 62 26 60 1