B0TCO1 -OEChem-04022117503D 53 56 0 0 0 0 0 0 0999 V2000 -2.2266 -3.1647 0.1582 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6812 -0.1144 -0.1853 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5842 -3.3845 1.5462 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -4.2173 -0.8237 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0317 -0.5420 1.6125 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9916 -1.7364 -0.4025 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5261 -2.6871 0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9612 0.5298 -0.2714 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 1.7989 -0.3232 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1574 -1.9312 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0715 -2.0920 1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2181 -2.9042 -1.0638 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3071 -0.5839 0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1055 2.0674 0.2967 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4132 -1.7141 1.1584 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5598 -2.5262 -1.1123 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5923 -1.5277 -0.0528 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1958 0.2991 -0.8781 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0433 2.8375 -0.9817 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8543 1.3376 -1.5367 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2779 2.6068 -1.5885 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0495 2.4936 1.6237 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9283 1.9000 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 2.7525 2.2217 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3051 2.1589 0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3612 2.5852 1.4925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9399 0.4178 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0554 -0.4188 -0.2559 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1054 1.7964 -0.4186 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3368 0.1230 -0.3584 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3865 2.3384 -0.5212 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5022 1.5017 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2748 -1.7267 -1.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4905 -1.9089 2.1183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -3.3583 -1.9435 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8677 -1.2485 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1252 -2.6981 -2.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0764 -1.8643 0.8739 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0663 -2.0267 -0.9083 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6618 -0.6825 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6097 3.8336 -1.0326 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8161 1.1584 -2.0082 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7907 3.4153 -2.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9575 2.6289 2.2066 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9538 1.5661 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7722 3.0836 3.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 2.0261 -0.4013 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3219 2.7850 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0045 -1.4968 -0.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2397 2.4527 -0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2064 -0.5274 -0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5154 3.4118 -0.6243 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4998 1.9237 -0.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 17 1 0 0 0 0 2 27 1 0 0 0 0 5 13 2 0 0 0 0 6 13 1 0 0 0 0 6 33 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 18 2 0 0 0 0 9 14 1 0 0 0 0 9 19 2 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 11 34 1 0 0 0 0 12 16 2 0 0 0 0 12 35 1 0 0 0 0 14 22 2 0 0 0 0 14 23 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 21 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 25 2 0 0 0 0 23 45 1 0 0 0 0 24 26 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 31 2 0 0 0 0 29 50 1 0 0 0 0 30 32 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$