B21JSB -OEChem-04012113173D 35 37 0 0 0 0 0 0 0999 V2000 1.4120 -2.1988 0.0261 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3506 -3.0733 0.8554 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0682 0.7164 -0.8434 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7387 2.8800 0.1483 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9819 2.8577 0.5145 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9872 -1.4857 -0.2724 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6518 0.2260 0.2039 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8037 -0.3847 -0.2318 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9466 0.6708 0.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7124 -1.0700 -0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5634 -1.1958 0.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 -1.1177 0.4163 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2941 -1.8978 0.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1765 -0.2262 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6496 0.1597 0.3619 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 1.9684 0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8353 0.8147 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5956 -1.9335 -0.3867 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9013 0.0956 -0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6833 1.0719 -0.3046 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8485 2.1510 -0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7812 -1.2786 -0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9398 2.2499 0.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2755 -2.4356 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1751 -0.6250 1.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0636 -0.3684 -0.3783 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8224 -1.0654 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8293 0.7087 0.8137 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8327 2.8134 0.4161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5139 -3.0023 -0.5588 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7476 1.2432 -0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6029 -1.8514 -1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2718 3.1485 0.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6879 0.0581 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8181 3.8456 0.3022 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 13 2 0 0 0 0 3 19 1 0 0 0 0 3 34 1 0 0 0 0 4 23 1 0 0 0 0 4 35 1 0 0 0 0 5 23 2 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 16 2 0 0 0 0 11 13 1 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 14 20 1 0 0 0 0 14 27 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 16 21 1 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 17 23 1 0 0 0 0 18 22 2 0 0 0 0 18 30 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 33 1 0 0 0 0 22 32 1 0 0 0 0 M END $$$$