B2FEW3 -OEChem-04022115273D 76 82 0 1 0 0 0 0 0999 V2000 2.3590 0.9016 0.9187 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -5.3651 0.4819 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3932 -2.7661 1.2592 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5654 0.8383 0.1242 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3167 3.4303 -0.4677 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3834 4.0867 -3.8688 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5382 5.3621 -2.3763 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4705 -1.5084 0.7883 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1864 0.1888 0.5335 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5503 -2.6238 0.5334 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8805 -2.1164 0.5027 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -3.1651 0.4845 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -0.7914 0.4796 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2817 -2.6706 1.0878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5728 -0.3586 0.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6115 -1.2717 0.6428 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9184 -3.3649 -0.7446 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0293 -0.2070 0.7105 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8123 -1.7014 1.1002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9496 -0.8601 0.5663 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 0.9560 0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -4.6976 -0.7032 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4738 -0.3759 1.2137 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8447 -2.6955 -1.9663 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2645 0.4468 0.2019 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 1.3531 -0.0761 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -5.3611 -1.8832 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1804 -3.3591 -3.1465 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7669 -0.2244 1.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5903 -4.6918 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4805 1.0603 1.6297 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8148 2.1931 -0.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8358 -6.7249 0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0682 1.6446 0.5077 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5675 1.6908 2.8708 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2953 2.4371 -0.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7431 2.8596 0.6268 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2425 2.9057 2.9901 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 3.4902 1.8681 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0388 2.2213 -1.4071 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9280 2.8799 0.9148 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4152 2.4482 -1.4059 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3044 3.1067 0.9161 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0480 2.8906 -0.2442 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7031 3.1738 -1.7301 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9378 4.3352 -2.6555 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6558 -3.2856 1.4018 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1306 -3.4782 -0.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6509 -4.0554 1.0407 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2124 -2.6729 2.1832 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0833 -3.3648 0.8088 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7489 -1.5615 0.7942 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1406 1.6912 -0.2126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5335 -1.6562 -2.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4135 2.3843 -0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9907 -6.3941 -1.9289 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -2.8378 -4.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3956 -1.0955 1.6745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8519 -5.2072 -4.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3516 2.8873 0.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4266 2.3978 -1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1325 -7.3493 -0.1296 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -6.8117 0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8399 -7.0987 1.4611 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 1.1189 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1148 1.2474 3.7543 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3103 3.3967 3.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3541 4.4369 1.9671 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5580 1.8743 -2.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3605 3.0495 1.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9943 2.2796 -2.3091 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7973 3.4508 1.8207 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1197 3.0668 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 3.0694 -1.6358 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1541 2.2784 -2.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5222 4.8299 -4.4938 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 23 1 0 0 0 0 2 22 1 0 0 0 0 2 33 1 0 0 0 0 3 19 2 0 0 0 0 4 25 1 0 0 0 0 4 32 1 0 0 0 0 5 37 1 0 0 0 0 5 45 1 0 0 0 0 6 46 1 0 0 0 0 6 76 1 0 0 0 0 7 46 2 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 13 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 14 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 20 1 0 0 0 0 17 22 1 0 0 0 0 17 24 2 0 0 0 0 19 23 1 0 0 0 0 20 25 2 0 0 0 0 20 52 1 0 0 0 0 21 26 2 0 0 0 0 21 53 1 0 0 0 0 22 27 2 0 0 0 0 23 29 2 0 0 0 0 24 28 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 26 55 1 0 0 0 0 27 30 1 0 0 0 0 27 56 1 0 0 0 0 28 30 2 0 0 0 0 28 57 1 0 0 0 0 29 31 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 31 34 2 0 0 0 0 31 35 1 0 0 0 0 32 36 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 37 1 0 0 0 0 34 65 1 0 0 0 0 35 38 2 0 0 0 0 35 66 1 0 0 0 0 36 40 2 0 0 0 0 36 41 1 0 0 0 0 37 39 2 0 0 0 0 38 39 1 0 0 0 0 38 67 1 0 0 0 0 39 68 1 0 0 0 0 40 42 1 0 0 0 0 40 69 1 0 0 0 0 41 43 2 0 0 0 0 41 70 1 0 0 0 0 42 44 2 0 0 0 0 42 71 1 0 0 0 0 43 44 1 0 0 0 0 43 72 1 0 0 0 0 44 73 1 0 0 0 0 45 46 1 0 0 0 0 45 74 1 0 0 0 0 45 75 1 0 0 0 0 M END $$$$