B1B3HE -OEChem-04022107362D 46 48 0 1 0 0 0 0 0999 V2000 9.5264 -3.4840 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 -1.2185 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3618 -2.0750 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 0.3907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 -0.2479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.9840 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 1.9840 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 3.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 -1.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.3524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 -1.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7631 -1.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3563 -1.9705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7576 -0.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9441 -2.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3454 -1.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9386 -2.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 3.9589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 3.9589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 2.8763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 3.5666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 1.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 2.0916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 4.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.7940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 2.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5446 -1.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4987 -2.0945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3743 -2.1404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4274 0.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0098 -0.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6919 -3.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9620 -1.6966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 21 1 0 0 0 0 4 15 2 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 6 18 2 0 0 0 0 7 18 1 0 0 0 0 7 20 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 1 0 0 0 8 26 1 0 0 0 0 9 14 1 1 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 44 1 0 0 0 0 23 25 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 M END $$$$