B2IO7L -OEChem-04022115153D 50 53 0 1 0 0 0 0 0999 V2000 3.3763 -1.9883 0.2527 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4096 3.3458 -1.2395 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0135 -2.6702 -0.9761 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3545 -2.5896 1.1403 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6685 4.0294 0.6473 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6469 1.9955 1.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9479 -1.6126 1.1393 N 0 0 2 0 0 0 0 0 0 0 0 0 -2.8131 -1.3431 -0.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8794 -0.8591 0.4389 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3941 -1.7274 0.3842 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6421 0.4820 1.1609 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5732 -0.8807 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6092 0.5017 0.0759 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4287 1.3295 0.4502 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9092 0.9071 -0.3076 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6358 -0.2370 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3963 2.2982 -0.4111 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0978 -1.1758 2.5491 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2573 -2.6573 -0.5152 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9777 -0.4833 -0.9778 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9873 -0.3874 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5236 -2.8816 -0.9011 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4032 -1.7504 -1.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2928 2.7263 0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8722 0.2830 0.6496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5832 0.2031 -1.3923 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3529 1.5438 0.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0639 1.4641 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9489 2.1344 -0.9005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1631 -0.6457 -0.5955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2547 -2.5314 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5782 -2.2024 1.3562 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2674 0.3442 2.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5589 1.0812 1.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7279 2.1594 1.1004 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0003 1.7642 -0.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5517 2.9956 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 2.4214 -1.3393 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5424 -0.1842 2.6557 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1541 -1.2605 3.0965 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7678 -1.8770 3.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5591 -3.4627 -0.3237 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 0.3494 -1.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9091 -3.8843 -1.0405 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4205 -1.9588 -1.4522 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1945 -0.1559 1.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9031 -0.3015 -2.0723 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0405 2.0670 0.9548 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 1.9237 -2.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2466 4.2973 1.3932 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 7 1 0 0 0 0 1 21 1 0 0 0 0 2 29 1 0 0 0 0 5 24 1 0 0 0 0 5 50 1 0 0 0 0 6 24 2 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 8 12 1 0 0 0 0 8 16 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 20 1 0 0 0 0 17 24 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 22 2 0 0 0 0 19 42 1 0 0 0 0 20 23 2 0 0 0 0 20 43 1 0 0 0 0 21 25 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 28 2 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 M END $$$$