B8T0XB -OEChem-04022117443D 46 49 0 1 0 0 0 0 0999 V2000 5.8463 -0.8603 0.8444 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5621 0.5541 1.9257 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0922 1.5132 -0.8380 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.8125 -1.6247 -1.7476 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7335 -0.3126 1.0347 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0638 0.1988 -0.1815 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2032 -0.6612 -0.5607 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8836 -1.5856 0.2804 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -0.4560 -0.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8885 -2.1765 -0.4886 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -0.7080 -1.8009 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7634 2.5792 -0.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6079 1.6507 -2.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3878 -0.0900 0.4097 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7407 -1.9776 1.6262 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4749 -1.4173 -1.3909 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -3.1435 0.0231 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6345 -0.6851 0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6063 -2.9438 2.1517 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3168 3.8839 -0.4634 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8847 2.3453 0.5427 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6003 -3.5165 1.3606 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7216 -2.0122 -1.5844 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8014 -1.6464 -0.7806 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9916 4.9549 0.1228 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5594 3.4162 1.1289 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 4.7210 0.9187 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1215 0.3556 0.9064 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6014 -0.1778 -2.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4193 -1.8623 -2.5201 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1182 2.3931 -2.7447 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6415 1.9762 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6188 0.7334 -2.6965 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2343 0.6635 1.1788 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -1.5431 2.2577 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6715 -1.7285 -2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5351 -3.5899 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5005 -3.2502 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5621 4.0980 -1.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2818 1.3551 0.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8524 -2.7587 -2.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2616 -4.2653 1.7891 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7578 -2.1306 -0.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6423 5.9707 -0.0376 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4339 3.2351 1.7471 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6384 5.5547 1.3752 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 2 5 2 0 0 0 0 3 6 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 30 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 14 2 0 0 0 0 9 16 1 0 0 0 0 10 17 2 0 0 0 0 11 29 1 0 0 0 0 12 20 2 0 0 0 0 12 21 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 18 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 35 1 0 0 0 0 16 23 2 0 0 0 0 16 36 1 0 0 0 0 17 22 1 0 0 0 0 17 37 1 0 0 0 0 18 24 2 0 0 0 0 19 22 2 0 0 0 0 19 38 1 0 0 0 0 20 25 1 0 0 0 0 20 39 1 0 0 0 0 21 26 2 0 0 0 0 21 40 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 43 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 2 1 -1 5 1 M END $$$$