B2R6WK -OEChem-04012113303D 67 70 0 1 0 0 0 0 0999 V2000 -0.4128 2.5839 1.2544 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5219 1.2187 2.7121 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9996 -1.1419 -1.9647 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5923 3.0022 0.2958 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8389 3.4874 2.3059 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3285 0.6351 0.6135 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5937 -0.1697 -0.9451 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0561 1.1028 1.9506 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 -3.2167 0.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2066 -1.9124 2.5197 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1423 0.0659 -0.7245 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 1.2461 0.8357 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3034 -0.8579 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7678 0.2968 0.4382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 0.2051 1.2288 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3404 0.7349 1.5919 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6946 -1.0510 -1.3322 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8276 -1.2362 1.6918 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9543 -0.2462 -1.6099 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2934 -1.9521 0.9787 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8623 2.1181 0.3562 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5842 -1.9281 1.5066 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0384 -2.6371 -0.2093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7555 1.6934 -0.9684 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1096 2.1756 0.9708 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -2.5893 0.8467 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8975 1.3206 -1.6958 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0742 -3.2983 -0.8695 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1658 1.3789 -1.0707 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2547 1.8085 0.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -3.2742 -0.3413 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8085 0.8905 -3.0298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -2.5653 1.3966 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3078 1.0061 -1.7983 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9535 0.5239 -3.7376 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2007 0.5818 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0726 0.9054 -1.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2245 -0.5134 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7539 1.5423 1.8833 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6738 2.1617 0.2322 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -1.7581 -0.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1662 -1.1765 -2.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7886 -0.5540 1.1326 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7072 0.8440 0.5617 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 0.3124 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4467 -1.5899 -2.2568 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 -1.8301 -0.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6665 -1.2913 2.7769 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7576 -1.7933 1.5141 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0137 0.9992 2.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2962 0.3158 -0.7372 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7994 0.4516 -2.4398 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7619 -1.3873 2.4328 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9626 -2.6652 -0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7795 1.6434 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 2.4953 2.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7875 -0.6029 -2.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8749 -3.8312 -1.7946 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2191 1.8586 0.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1325 -3.8035 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8438 0.8367 -3.5302 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2929 1.0427 -1.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8708 0.1928 -4.7687 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0917 0.2960 -3.6744 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9539 -3.1863 1.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9253 -3.7369 -0.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2037 -2.0095 2.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 21 1 0 0 0 0 2 16 2 0 0 0 0 3 19 1 0 0 0 0 3 57 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 17 1 0 0 0 0 8 15 1 0 0 0 0 8 50 1 0 0 0 0 9 33 1 0 0 0 0 9 65 1 0 0 0 0 9 66 1 0 0 0 0 10 33 2 0 0 0 0 10 67 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 45 1 0 0 0 0 17 19 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 20 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 1 0 0 0 0 22 53 1 0 0 0 0 23 28 2 0 0 0 0 23 54 1 0 0 0 0 24 27 1 0 0 0 0 24 55 1 0 0 0 0 25 30 2 0 0 0 0 25 56 1 0 0 0 0 26 31 2 0 0 0 0 26 33 1 0 0 0 0 27 29 1 0 0 0 0 27 32 2 0 0 0 0 28 31 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 32 35 1 0 0 0 0 32 61 1 0 0 0 0 34 36 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 M END $$$$