@MOLECULE 1-[2-methoxy-4-[(E)-2-nitrovinyl]phenyl]propan-1-one 30 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.7246 2.0432 -0.5344 O.3 1 UNL11111111111 -0.3157 2 O -3.8304 -0.2254 1.2181 O.2 1 UNL11111111111 -0.4323 3 O 5.2729 0.6874 0.4535 O.2 1 UNL11111111111 -0.4093 4 O 5.5576 -0.9192 -0.9529 O.2 1 UNL11111111111 -0.3908 5 N 4.8482 -0.2080 -0.2608 N.pl3 1 UNL11111111111 0.6236 6 C -1.6495 -0.2707 0.3279 C.ar 1 UNL11111111111 -0.2822 7 C -1.0911 0.9492 -0.0520 C.ar 1 UNL11111111111 0.2843 8 C -3.1061 -0.5649 0.3178 C.2 1 UNL11111111111 0.4850 9 C -3.5901 -1.3588 -0.8701 C.3 1 UNL11111111111 -0.3591 10 C 1.1253 0.1005 0.3833 C.ar 1 UNL11111111111 0.0313 11 C -0.8012 -1.2999 0.7522 C.ar 1 UNL11111111111 -0.0585 12 C 0.3051 1.1413 -0.0254 C.ar 1 UNL11111111111 -0.2440 13 C 0.5752 -1.1268 0.7777 C.ar 1 UNL11111111111 -0.2134 14 C -5.1059 -1.2852 -1.0039 C.3 1 UNL11111111111 -0.4175 15 C 2.5744 0.3088 0.4150 C.2 1 UNL11111111111 -0.0416 16 C -3.1152 2.2024 -0.2928 C.3 1 UNL11111111111 -0.2065 17 C 3.4186 -0.4488 -0.2977 C.2 1 UNL11111111111 -0.2047 18 H -3.0969 -1.0072 -1.7992 H 1 UNL11111111111 0.1664 19 H -3.2639 -2.4144 -0.7506 H 1 UNL11111111111 0.1701 20 H -1.2320 -2.2518 1.0706 H 1 UNL11111111111 0.1571 21 H 0.7118 2.1057 -0.3287 H 1 UNL11111111111 0.1847 22 H 1.2238 -1.9337 1.1123 H 1 UNL11111111111 0.1684 23 H -5.6023 -1.5555 -0.0600 H 1 UNL11111111111 0.1644 24 H -5.4427 -0.2736 -1.2588 H 1 UNL11111111111 0.1466 25 H -5.4750 -1.9642 -1.7803 H 1 UNL11111111111 0.1453 26 H 2.9250 1.1350 1.0533 H 1 UNL11111111111 0.1947 27 H -3.2839 3.2380 -0.6226 H 1 UNL11111111111 0.1589 28 H -3.3527 2.0982 0.7731 H 1 UNL11111111111 0.1589 29 H -3.6970 1.5084 -0.9068 H 1 UNL11111111111 0.1359 30 H 3.1245 -1.2741 -0.9515 H 1 UNL11111111111 0.1999 @BOND 1 1 7 1 2 1 16 1 3 2 8 2 4 3 5 2 5 4 5 2 6 5 17 1 7 6 7 ar 8 6 8 1 9 6 11 ar 10 7 12 ar 11 8 9 1 12 9 14 1 13 9 18 1 14 9 19 1 15 10 12 ar 16 10 13 ar 17 10 15 1 18 11 13 ar 19 11 20 1 20 12 21 1 21 13 22 1 22 14 23 1 23 14 24 1 24 14 25 1 25 15 17 2 26 15 26 1 27 16 27 1 28 16 28 1 29 16 29 1 30 17 30 1