BO2DW9 -OEChem-04022114303D 57 58 0 1 0 0 0 0 0999 V2000 1.4234 0.2910 -0.9089 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9418 0.5625 2.6114 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5354 5.2354 -1.5311 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0196 -2.2212 1.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5638 -0.1766 -2.6399 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4057 -1.7143 -1.2563 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0987 5.4478 0.6381 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5137 -2.1267 0.2813 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8387 -2.3853 -1.8737 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 0.5978 0.6091 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7169 0.2368 1.0488 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4675 1.1043 1.1467 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4945 2.6369 1.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2433 3.2266 -0.2978 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5743 0.4862 0.2943 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 0.3668 1.4001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0783 -0.1806 0.6998 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2091 4.7383 -0.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9374 -0.3263 0.6066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2701 0.0778 -0.6574 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0042 -0.9540 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1218 -1.4688 0.7433 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3878 -0.4371 -1.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3137 -1.2102 -0.6139 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0898 -0.7008 -0.7284 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9876 -0.5082 1.5064 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2925 -1.2571 -1.1637 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1903 -1.0646 1.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3429 -1.4389 -0.2639 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5963 -2.0194 -0.7188 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7489 -2.4378 2.8225 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5706 0.6218 -3.2807 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2681 -3.0022 -1.8521 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5634 0.7718 2.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4614 2.9995 1.4636 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2649 3.0267 1.7825 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0438 2.9089 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7126 2.8839 -0.7078 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7835 0.3574 -0.3765 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 0.4815 2.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5603 0.7192 -1.1636 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8054 -1.1310 2.4514 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3234 -0.5940 -1.4829 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8813 -0.2208 2.5494 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3923 -1.5433 -2.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9819 -1.1887 1.8048 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5006 6.2156 -1.5479 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5641 -3.0536 3.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7587 -1.4999 3.3882 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8239 -3.0058 2.9692 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8642 0.7164 -4.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5894 0.1348 -3.2701 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5405 1.6366 -2.8693 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2191 -3.2648 -2.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0348 -3.7553 -1.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4887 -2.9901 -2.6206 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3551 -2.5190 -0.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 16 2 0 0 0 0 3 18 1 0 0 0 0 3 47 1 0 0 0 0 4 22 1 0 0 0 0 4 31 1 0 0 0 0 5 23 1 0 0 0 0 5 32 1 0 0 0 0 6 24 1 0 0 0 0 6 33 1 0 0 0 0 7 18 2 0 0 0 0 8 30 1 0 0 0 0 8 57 1 0 0 0 0 9 30 2 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 10 39 1 0 0 0 0 11 15 1 0 0 0 0 11 19 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 18 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 19 25 2 0 0 0 0 19 26 1 0 0 0 0 20 23 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 23 24 2 0 0 0 0 25 27 1 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 26 44 1 0 0 0 0 27 29 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 M END $$$$