@MOLECULE (+)-flesinoxan 56 59 0 0 0 SMALL GASTEIGER @ATOM 1 F -9.9695 1.7195 0.8700 F 1 UNL1111111111 -0.1699 2 O 4.0880 1.0509 -0.1247 O.3 1 UNL1111111111 -0.2696 3 O 6.8984 0.5952 0.0376 O.3 1 UNL1111111111 -0.3414 4 O 8.3886 2.9886 0.8098 O.3 1 UNL1111111111 -0.5327 5 O -4.9683 -0.9145 -1.8203 O.2 1 UNL1111111111 -0.5154 6 N -0.4856 -0.7693 -0.2883 N.3 1 UNL1111111111 -0.4173 7 N 2.3400 -1.0127 0.0672 N.pl3 1 UNL1111111111 -0.4159 8 N -4.1837 -0.7991 0.2987 N.am 1 UNL1111111111 -0.6065 9 C 0.0935 -1.4213 0.9128 C.3 1 UNL1111111111 -0.1223 10 C 0.4394 0.2797 -0.7881 C.3 1 UNL1111111111 -0.1200 11 C 1.4377 -2.0882 0.5245 C.3 1 UNL1111111111 -0.0988 12 C 1.7971 -0.3679 -1.1492 C.3 1 UNL1111111111 -0.0919 13 C -1.8134 -0.1848 0.0097 C.3 1 UNL1111111111 -0.1525 14 C 3.7206 -1.2939 0.0383 C.ar 1 UNL1111111111 0.1792 15 C 4.6214 -0.2083 -0.0215 C.ar 1 UNL1111111111 0.0058 16 C -2.8671 -1.3192 -0.0764 C.3 1 UNL1111111111 -0.0674 17 C 4.2597 -2.5824 0.1798 C.ar 1 UNL1111111111 -0.2801 18 C 5.9958 -0.4261 0.0865 C.ar 1 UNL1111111111 0.1756 19 C 6.3196 1.8895 0.2517 C.3 1 UNL1111111111 0.0086 20 C 5.0383 2.0144 -0.5708 C.3 1 UNL1111111111 -0.1221 21 C 5.6367 -2.7801 0.2689 C.ar 1 UNL1111111111 -0.0837 22 C 6.5234 -1.7106 0.2253 C.ar 1 UNL1111111111 -0.2492 23 C 7.4194 2.8540 -0.2039 C.3 1 UNL1111111111 -0.0253 24 C -5.1577 -0.6041 -0.6611 C.2 1 UNL1111111111 0.5827 25 C -6.4379 0.0022 -0.2001 C.ar 1 UNL1111111111 -0.1692 26 C -7.0933 0.8510 -1.0968 C.ar 1 UNL1111111111 -0.0461 27 C -6.9936 -0.2852 1.0467 C.ar 1 UNL1111111111 -0.0808 28 C -8.3003 1.4449 -0.7424 C.ar 1 UNL1111111111 -0.2371 29 C -8.2001 0.2989 1.4237 C.ar 1 UNL1111111111 -0.2366 30 C -8.8241 1.1568 0.5181 C.ar 1 UNL1111111111 0.2301 31 H -0.6092 -2.2012 1.2716 H 1 UNL1111111111 0.1340 32 H 0.2641 -0.7080 1.7483 H 1 UNL1111111111 0.1306 33 H -0.0015 0.7297 -1.7034 H 1 UNL1111111111 0.1408 34 H 0.6030 1.0942 -0.0500 H 1 UNL1111111111 0.1303 35 H 1.2650 -2.8633 -0.2537 H 1 UNL1111111111 0.1370 36 H 1.8725 -2.5831 1.4191 H 1 UNL1111111111 0.1431 37 H 2.4964 0.4157 -1.5113 H 1 UNL1111111111 0.1527 38 H 1.6597 -1.1024 -1.9741 H 1 UNL1111111111 0.1366 39 H -1.8588 0.3208 0.9954 H 1 UNL1111111111 0.1175 40 H -2.0613 0.5853 -0.7547 H 1 UNL1111111111 0.1513 41 H -2.6037 -2.1657 0.5932 H 1 UNL1111111111 0.1383 42 H -2.8891 -1.7316 -1.1158 H 1 UNL1111111111 0.1875 43 H 3.6010 -3.4459 0.2068 H 1 UNL1111111111 0.1627 44 H 6.1165 1.9810 1.3440 H 1 UNL1111111111 0.1650 45 H 5.2196 1.8639 -1.6497 H 1 UNL1111111111 0.1445 46 H 4.5086 2.9693 -0.4032 H 1 UNL1111111111 0.1596 47 H 6.0244 -3.7938 0.3739 H 1 UNL1111111111 0.1537 48 H 7.5965 -1.8543 0.3002 H 1 UNL1111111111 0.1725 49 H -4.2942 -0.4697 1.2408 H 1 UNL1111111111 0.3065 50 H 7.9071 2.5098 -1.1355 H 1 UNL1111111111 0.1369 51 H 7.0407 3.8850 -0.3350 H 1 UNL1111111111 0.1500 52 H 8.7776 2.1124 1.0236 H 1 UNL1111111111 0.3241 53 H -6.6549 1.0356 -2.0832 H 1 UNL1111111111 0.1787 54 H -6.4991 -0.9794 1.7273 H 1 UNL1111111111 0.1578 55 H -8.8198 2.1082 -1.4324 H 1 UNL1111111111 0.1801 56 H -8.6427 0.0856 2.3950 H 1 UNL1111111111 0.1776 @BOND 1 1 30 1 2 2 15 1 3 2 20 1 4 3 18 1 5 3 19 1 6 4 23 1 7 4 52 1 8 5 24 2 9 6 9 1 10 6 10 1 11 6 13 1 12 7 11 1 13 7 12 1 14 7 14 1 15 8 16 1 16 8 24 am 17 8 49 1 18 9 11 1 19 9 31 1 20 9 32 1 21 10 12 1 22 10 33 1 23 10 34 1 24 11 35 1 25 11 36 1 26 12 37 1 27 12 38 1 28 13 16 1 29 13 39 1 30 13 40 1 31 14 15 ar 32 14 17 ar 33 15 18 ar 34 16 41 1 35 16 42 1 36 17 21 ar 37 17 43 1 38 18 22 ar 39 19 20 1 40 19 23 1 41 19 44 1 42 20 45 1 43 20 46 1 44 21 22 ar 45 21 47 1 46 22 48 1 47 23 50 1 48 23 51 1 49 24 25 1 50 25 26 ar 51 25 27 ar 52 26 28 ar 53 26 53 1 54 27 29 ar 55 27 54 1 56 28 30 ar 57 28 55 1 58 29 30 ar 59 29 56 1