BO3FU5 -OEChem-04012117162D 51 53 0 1 0 0 0 0 0999 V2000 8.0785 0.6981 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 3.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0785 0.6865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0786 0.7096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 1.6980 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 0.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 3.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 -0.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2052 1.6282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 2.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 2.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 2.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -0.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 2.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 1.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 3.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2052 3.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -2.8499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -2.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 3.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -2.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 -0.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0598 -0.9218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6869 -0.3090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -3.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -3.7673 0.0000 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 6 1 0 0 0 0 1 25 1 0 0 0 0 2 15 1 0 0 0 0 2 19 1 0 0 0 0 5 20 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 20 1 0 0 0 0 8 11 2 0 0 0 0 9 15 2 0 0 0 0 9 17 1 0 0 0 0 10 19 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 16 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 17 2 0 0 0 0 13 22 1 0 0 0 0 14 18 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 23 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 26 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 M END $$$$