BT57XP -OEChem-04022116383D 56 58 0 1 0 0 0 0 0999 V2000 1.1149 2.6756 -0.8050 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0182 1.2612 1.4610 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8839 1.2317 1.8751 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6035 1.9382 -0.0450 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.8933 -3.3334 0.0980 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7781 -0.6264 -2.1847 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1099 -1.8288 -1.4524 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1127 -2.6750 -1.5304 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6311 2.6920 -2.1581 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6764 3.8971 -0.1623 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 -0.7825 0.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3475 -2.8145 1.7384 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1272 1.5064 -0.6953 N 0 0 2 0 0 0 0 0 0 0 0 0 -2.4471 -0.0835 -0.3722 N 0 0 2 0 0 0 0 0 0 0 0 0 3.1102 -2.5782 1.3034 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1751 1.5170 -1.7652 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9514 0.1948 -1.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6613 1.2426 0.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4338 -0.0726 0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0984 2.7301 -1.6581 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5787 -0.8948 -0.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3362 1.9311 0.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7374 -0.4148 0.3641 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9964 0.7759 -0.1883 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -2.1986 -0.7414 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 0.1881 0.6302 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6407 2.4985 1.4681 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6667 -1.0471 0.1827 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8570 -1.2386 0.4804 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2654 0.7555 1.8676 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8069 0.9772 0.9025 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6055 1.9109 2.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6596 -3.0224 -0.6247 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8181 -2.5424 -0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4183 -1.5434 -1.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4349 -2.2268 1.1596 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6733 1.5573 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7802 0.2381 -2.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2911 -0.6246 -2.0402 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1418 1.1581 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3066 2.0690 0.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8919 -0.2061 1.6728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7461 -0.9141 0.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5444 3.6546 -1.8515 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5522 2.8307 -0.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9031 2.6727 -2.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7367 0.3654 -1.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6441 -2.5927 -1.2145 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1401 3.3954 1.8206 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7705 -0.8875 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0034 0.3115 2.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 2.3507 3.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6293 -4.0380 -1.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3493 -0.6143 1.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8372 -3.3413 1.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3628 -2.1015 0.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 1 10 2 0 0 0 0 1 13 1 0 0 0 0 1 22 1 0 0 0 0 2 31 1 0 0 0 0 3 31 1 0 0 0 0 4 31 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 35 1 0 0 0 0 8 35 1 0 0 0 0 11 28 1 0 0 0 0 11 54 1 0 0 0 0 12 36 2 0 0 0 0 13 16 1 0 0 0 0 13 18 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 14 21 1 0 0 0 0 15 36 1 0 0 0 0 15 55 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 23 2 0 0 0 0 21 25 1 0 0 0 0 22 24 1 0 0 0 0 22 27 2 0 0 0 0 23 29 1 0 0 0 0 23 31 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 33 2 0 0 0 0 25 48 1 0 0 0 0 26 28 1 0 0 0 0 26 30 1 0 0 0 0 27 32 1 0 0 0 0 27 49 1 0 0 0 0 28 35 1 0 0 0 0 28 36 1 0 0 0 0 29 34 2 0 0 0 0 29 50 1 0 0 0 0 30 32 2 0 0 0 0 30 51 1 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 M END $$$$