BT1SG3 -OEChem-04012112353D 55 58 0 0 0 0 0 0 0999 V2000 -0.4317 0.2427 -1.4182 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9085 1.8491 -0.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3513 6.6519 0.5149 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0531 2.8861 0.6017 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0672 1.6125 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6401 4.2640 0.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 0.5694 -0.6681 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2806 1.1245 -0.5696 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4093 1.4974 0.3912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6584 0.7211 0.1413 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7888 -0.7682 -0.9968 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8139 5.4057 1.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6313 -1.7557 -0.4607 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9964 0.9514 0.1912 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -1.3741 0.4168 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8676 -0.4933 0.7954 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0382 -1.2358 0.5709 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8431 -0.0163 0.7327 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6147 1.2092 -0.7441 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0108 -0.7395 -0.3295 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7838 0.4848 -0.9788 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4624 -3.1136 -0.7772 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5166 -2.3618 0.9527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2653 -2.4600 1.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1815 -1.4822 -0.5539 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3087 -4.0814 -0.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3337 -3.7062 0.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -3.1847 0.9858 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3902 -2.6969 0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4753 2.6470 1.4972 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0957 2.9234 0.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6046 2.5539 -1.4182 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7274 1.2838 -2.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 4.4895 -0.8221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4021 4.2342 -0.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0823 1.2991 1.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6352 2.5644 0.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9881 -1.0537 -1.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8677 5.4996 1.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2507 5.1899 1.9907 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1596 1.9949 0.4439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -0.8689 1.4846 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6397 0.3001 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4623 2.1529 -1.2613 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5174 0.8853 -1.6755 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6677 -3.4299 -1.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3245 -2.0915 1.6295 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5317 -2.8607 1.9172 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9426 -1.1200 -1.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8598 6.8568 -0.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6289 6.5711 0.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -5.1282 -0.4879 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9922 -4.4602 1.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5972 -4.1302 1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2999 -3.2616 -0.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 8 1 0 0 0 0 3 12 1 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 4 6 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 7 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 12 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 11 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 16 2 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 15 1 0 0 0 0 13 22 2 0 0 0 0 14 18 2 0 0 0 0 14 41 1 0 0 0 0 15 18 1 0 0 0 0 15 23 2 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 20 1 0 0 0 0 17 24 2 0 0 0 0 18 43 1 0 0 0 0 19 21 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 45 1 0 0 0 0 22 26 1 0 0 0 0 22 46 1 0 0 0 0 23 27 1 0 0 0 0 23 47 1 0 0 0 0 24 28 1 0 0 0 0 24 48 1 0 0 0 0 25 29 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 M END $$$$