B1FGY3 -OEChem-04022110182D 54 58 0 1 0 0 0 0 0999 V2000 5.3934 -1.2274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 0.2726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3934 2.7726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.2726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2594 0.2726 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6254 4.3024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 -2.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 -3.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 -3.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -4.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -4.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 -1.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 -3.0830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 -3.0830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -5.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -5.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1254 1.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2594 1.2726 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1254 2.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 -3.8516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -4.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -4.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9302 3.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6195 4.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3934 -0.2274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3207 3.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9087 3.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3934 1.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2874 5.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5765 3.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2658 4.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0798 -2.4460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3153 -1.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9168 -1.8351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5365 -2.4911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 -2.4911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5139 -5.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -5.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3375 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 1.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7964 0.9626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6607 -3.7204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -3.7204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1459 -5.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -5.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7964 -0.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7314 3.1636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2593 4.8027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1013 2.5606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0947 5.6403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1832 3.7664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6799 5.3062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8564 3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 26 1 0 0 0 0 2 26 2 0 0 0 0 3 29 1 0 0 0 0 3 54 1 0 0 0 0 4 29 2 0 0 0 0 18 5 1 1 0 0 0 5 26 1 0 0 0 0 5 47 1 0 0 0 0 6 25 1 0 0 0 0 6 27 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 11 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 16 2 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 20 1 0 0 0 0 13 36 1 0 0 0 0 14 21 1 0 0 0 0 14 37 1 0 0 0 0 15 22 1 0 0 0 0 15 38 1 0 0 0 0 16 23 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 29 1 0 0 0 0 18 42 1 0 0 0 0 19 24 1 0 0 0 0 19 27 2 0 0 0 0 20 22 2 0 0 0 0 20 43 1 0 0 0 0 21 23 2 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 28 2 0 0 0 0 25 30 2 0 0 0 0 27 48 1 0 0 0 0 28 31 1 0 0 0 0 28 50 1 0 0 0 0 30 32 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$