B35IQR -OEChem-04012117462D 40 42 0 0 0 0 0 0 0999 V2000 5.1499 1.0332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8249 -1.0546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1249 -1.3552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5929 -3.5934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0929 -1.0546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2778 3.7068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5929 -3.5934 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 3.9147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 -3.0025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0929 -2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8711 2.7933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9019 -2.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4589 1.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1807 -4.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2839 -2.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 0.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 -0.5546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4589 1.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7679 1.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7739 -5.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3328 -2.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 4.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 5.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3605 4.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3571 3.1400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4404 2.3473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4916 -2.4508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6947 -4.7491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6114 -3.9564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5559 -0.7446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8233 2.4858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3576 0.8416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2075 -5.0638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5218 -5.8824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3403 -5.5682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1612 4.6376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 5.9224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8975 5.2192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7186 -3.6089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 16 1 0 0 0 0 2 17 2 0 0 0 0 3 21 2 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 5 30 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 22 1 0 0 0 0 7 15 2 0 0 0 0 8 24 2 0 0 0 0 9 21 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 13 18 2 0 0 0 0 14 20 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$