@MOLECULE (2r)-2-(4-nitrophenyl)oxirane 19 20 0 0 0 SMALL USER_CHARGES @ATOM 1 O -3.6153 -0.7855 -0.1927 O.3 1 UNL11111111 -0.3150 2 O 3.4796 0.9122 0.1350 O.2 1 UNL11111111 -0.4008 3 O 3.2970 -1.2315 0.1156 O.2 1 UNL11111111 -0.3949 4 N 2.8151 -0.1110 0.0814 N.pl3 1 UNL11111111 0.6226 5 C -2.8456 0.4126 -0.3362 C.3 1 UNL11111111 -0.0228 6 C -3.7089 0.1776 0.8583 C.3 1 UNL11111111 -0.1311 7 C -1.3780 0.2616 -0.2308 C.ar 1 UNL11111111 0.0238 8 C -0.5813 1.4093 -0.1762 C.ar 1 UNL11111111 -0.1840 9 C -0.7979 -1.0084 -0.1892 C.ar 1 UNL11111111 -0.1621 10 C 0.7993 1.2910 -0.0721 C.ar 1 UNL11111111 -0.0795 11 C 0.5833 -1.1387 -0.0886 C.ar 1 UNL11111111 -0.0810 12 C 1.3695 0.0150 -0.0284 C.ar 1 UNL11111111 -0.0846 13 H -3.1919 1.0681 -1.1464 H 1 UNL11111111 0.1695 14 H -3.2766 -0.1312 1.8079 H 1 UNL11111111 0.1584 15 H -4.6749 0.6681 0.9545 H 1 UNL11111111 0.1563 16 H -1.0408 2.3967 -0.2123 H 1 UNL11111111 0.1665 17 H -1.4342 -1.8963 -0.2367 H 1 UNL11111111 0.1834 18 H 1.4349 2.1815 -0.0254 H 1 UNL11111111 0.1865 19 H 1.0503 -2.1290 -0.0571 H 1 UNL11111111 0.1889 @BOND 1 13 5 1 2 5 7 1 3 5 1 1 4 5 6 1 5 17 9 1 6 7 9 ar 7 7 8 ar 8 16 8 1 9 1 6 1 10 9 11 ar 11 8 10 ar 12 11 19 1 13 11 12 ar 14 10 12 ar 15 10 18 1 16 12 4 1 17 4 3 2 18 4 2 2 19 6 15 1 20 6 14 1