B3GU7S -OEChem-04022110023D 47 50 0 1 0 0 0 0 0999 V2000 0.6503 -2.4058 -0.6994 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3402 -0.3411 -0.2395 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6076 -1.6785 -0.1264 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9322 -2.0450 1.5512 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0516 -0.2347 0.1992 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8682 0.6054 -0.8053 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2045 -0.6999 0.8738 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6444 -0.8179 0.4502 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3005 0.7552 -0.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5402 0.2555 0.1855 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7647 -0.3117 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3296 -1.9941 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 -1.6627 0.2769 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2421 -0.1775 -0.8519 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5943 -0.0515 -0.4935 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6963 1.8247 0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9968 1.0360 0.3178 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4266 1.6596 0.2175 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0354 1.9654 0.7469 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8856 0.4581 -0.5047 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5395 2.4423 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5556 -0.9810 -0.9226 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7491 1.8487 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3489 1.1619 0.6762 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8946 -0.8404 -0.5569 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2906 0.2290 0.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1139 0.2574 1.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4163 1.6017 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8128 0.1599 -1.8086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9015 -1.6579 1.3135 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1416 0.0525 1.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6429 0.5584 -0.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0242 -3.0273 0.3405 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 -1.0068 -1.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3315 -2.3510 -0.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9717 2.5565 0.7289 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4911 2.1384 0.4926 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3222 2.8087 1.3717 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8277 -0.0031 -0.7814 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4577 3.5258 -0.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -1.8250 -1.5467 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6008 2.4757 -0.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6808 1.9899 1.2991 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8588 -1.4242 2.3506 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.9770 1.7327 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6282 -1.5663 -0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3332 0.3378 0.5252 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 32 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 35 1 0 0 0 0 4 13 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 27 1 0 0 0 0 6 9 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 14 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 18 2 0 0 0 0 11 20 2 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 17 1 0 0 0 0 15 22 2 0 0 0 0 16 19 2 0 0 0 0 16 36 1 0 0 0 0 17 19 1 0 0 0 0 17 24 2 0 0 0 0 18 21 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 23 1 0 0 0 0 20 39 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 26 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 M END $$$$