@MOLECULE (2S,3R)-2-[(1S)-1-methylpropyl]-3-propyl-oxirane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.2468 1.0700 1.0232 C.3 1 UNL11111111 -0.4356 2 C -2.6058 -0.0616 0.2220 C.3 1 UNL11111111 -0.2598 3 C -1.1652 0.2843 -0.2020 C.3 1 UNL11111111 -0.1054 4 H -0.6266 0.7048 0.6826 H 1 UNL11111111 0.1488 5 C -1.1400 1.3108 -1.3384 C.3 1 UNL11111111 -0.4485 6 C -0.4798 -0.9835 -0.6673 C.3 1 UNL11111111 -0.0152 7 H -0.9178 -1.4283 -1.5682 H 1 UNL11111111 0.1477 8 O -0.1799 -1.9426 0.3529 O.3 1 UNL11111111 -0.3628 9 C 0.9309 -1.3289 -0.3092 C.3 1 UNL11111111 0.0017 10 H 1.4848 -2.0124 -0.9637 H 1 UNL11111111 0.1462 11 C 1.8005 -0.4554 0.5569 C.3 1 UNL11111111 -0.2973 12 C 2.5908 0.5335 -0.3083 C.3 1 UNL11111111 -0.2431 13 C 3.5126 1.3934 0.5547 C.3 1 UNL11111111 -0.4380 14 H -3.3112 1.9932 0.4375 H 1 UNL11111111 0.1410 15 H -4.2644 0.8058 1.3333 H 1 UNL11111111 0.1419 16 H -2.6749 1.2919 1.9315 H 1 UNL11111111 0.1432 17 H -2.5913 -0.9876 0.8340 H 1 UNL11111111 0.1503 18 H -3.2196 -0.2967 -0.6666 H 1 UNL11111111 0.1359 19 H -1.5446 2.2738 -1.0072 H 1 UNL11111111 0.1482 20 H -0.1190 1.4881 -1.6941 H 1 UNL11111111 0.1429 21 H -1.7383 0.9827 -2.1954 H 1 UNL11111111 0.1465 22 H 1.1965 0.0855 1.3125 H 1 UNL11111111 0.1558 23 H 2.4913 -1.0908 1.1480 H 1 UNL11111111 0.1543 24 H 3.1836 -0.0134 -1.0662 H 1 UNL11111111 0.1356 25 H 1.8933 1.1786 -0.8770 H 1 UNL11111111 0.1368 26 H 2.9468 1.9809 1.2864 H 1 UNL11111111 0.1442 27 H 4.2307 0.7796 1.1102 H 1 UNL11111111 0.1442 28 H 4.0875 2.0973 -0.0573 H 1 UNL11111111 0.1406 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 1 7 6 8 1 8 8 9 1 9 9 10 1 10 6 9 1 11 9 11 1 12 11 12 1 13 12 13 1 14 1 14 1 15 1 15 1 16 1 16 1 17 2 17 1 18 2 18 1 19 5 19 1 20 5 20 1 21 5 21 1 22 11 22 1 23 11 23 1 24 12 24 1 25 12 25 1 26 13 26 1 27 13 27 1 28 13 28 1