BTL80E -OEChem-04022108123D 53 53 0 1 0 0 0 0 0999 V2000 2.4911 -1.9276 1.7919 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1066 1.5335 0.9291 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3502 -0.5612 0.0119 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 0.3097 2.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 2.6128 0.8536 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6368 -0.8836 -0.2784 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5987 0.9762 -1.8677 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5906 1.3684 0.2604 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9453 -2.2516 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6196 -2.5047 -0.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0767 -1.8177 0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5715 -2.8592 -0.9745 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3499 -1.4920 -0.6575 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8512 -3.1546 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1353 0.3881 0.1917 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4896 -1.0241 0.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3546 -1.9433 0.5716 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6533 1.5514 -0.6877 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1519 1.6516 -0.8356 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6496 0.3860 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1936 0.2701 0.9841 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4296 2.4120 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9492 2.4835 -0.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7439 1.0693 -1.9957 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 1.8023 -1.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5212 1.6045 1.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2427 -3.1688 -1.3274 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7947 -1.4923 -1.5764 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3718 -1.6068 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7689 -3.3114 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -2.6119 0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7466 -0.9374 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7281 -2.0557 -1.7023 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3141 -3.7521 -1.5579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1305 -0.7135 -1.3984 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6754 -2.3818 -1.2093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6415 -3.4769 -0.8828 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6842 -3.9708 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7319 0.5250 1.2045 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3991 -0.8989 -0.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 -1.7906 0.9967 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5983 -1.0297 -1.2827 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0396 2.5063 -0.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0869 1.4462 -1.6921 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9116 2.9376 0.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 1.3666 -0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5515 3.0676 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1661 0.5257 -2.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6281 1.8431 -1.2915 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7489 2.5677 1.5994 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0469 1.5432 0.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8466 0.8050 1.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4889 2.8334 0.4363 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 20 1 0 0 0 0 2 26 1 0 0 0 0 3 20 2 0 0 0 0 4 21 2 0 0 0 0 5 8 1 0 0 0 0 5 53 1 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 6 42 1 0 0 0 0 7 19 1 0 0 0 0 7 24 2 0 0 0 0 8 21 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 16 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 17 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 18 1 0 0 0 0 15 20 1 0 0 0 0 15 39 1 0 0 0 0 16 21 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 22 2 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 25 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END $$$$