@MOLECULE (2R,3S)-2-ethyl-3-isopropyl-oxirane 22 22 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.2173 -0.4552 -0.2632 C.3 1 UNL11111111 -0.4331 2 C 1.6979 -0.5595 -0.3875 C.3 1 UNL11111111 -0.2760 3 C 1.0103 0.3715 0.5795 C.3 1 UNL11111111 0.0025 4 H 1.5939 0.6309 1.4695 H 1 UNL11111111 0.1494 5 O 0.3362 1.4910 -0.0076 O.3 1 UNL11111111 -0.3624 6 C -0.4787 0.5031 0.6311 C.3 1 UNL11111111 -0.0180 7 H -0.9509 0.8525 1.5552 H 1 UNL11111111 0.1486 8 C -1.3931 -0.2842 -0.2839 C.3 1 UNL11111111 -0.0855 9 C -1.7574 -1.6143 0.3828 C.3 1 UNL11111111 -0.4507 10 C -2.6510 0.5406 -0.5761 C.3 1 UNL11111111 -0.4474 11 H 3.5574 0.5776 -0.4142 H 1 UNL11111111 0.1521 12 H 3.5668 -0.7785 0.7237 H 1 UNL11111111 0.1423 13 H 3.7205 -1.0779 -1.0116 H 1 UNL11111111 0.1441 14 H 1.3908 -0.3178 -1.4278 H 1 UNL11111111 0.1587 15 H 1.3696 -1.6030 -0.2080 H 1 UNL11111111 0.1456 16 H -0.8701 -0.4863 -1.2517 H 1 UNL11111111 0.1458 17 H -0.8640 -2.2025 0.6198 H 1 UNL11111111 0.1434 18 H -2.3081 -1.4596 1.3175 H 1 UNL11111111 0.1476 19 H -2.3909 -2.2227 -0.2724 H 1 UNL11111111 0.1477 20 H -2.3857 1.5204 -0.9945 H 1 UNL11111111 0.1556 21 H -3.2976 0.0341 -1.3002 H 1 UNL11111111 0.1448 22 H -3.2422 0.7185 0.3283 H 1 UNL11111111 0.1449 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 5 6 1 6 6 7 1 7 3 6 1 8 6 8 1 9 8 9 1 10 8 10 1 11 1 11 1 12 1 12 1 13 1 13 1 14 2 14 1 15 2 15 1 16 8 16 1 17 9 17 1 18 9 18 1 19 9 19 1 20 10 20 1 21 10 21 1 22 10 22 1