D0H3YR -OEChem-10191521262D 46 49 0 1 0 0 0 0 0999 V2000 3.4030 2.7192 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1629 1.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9331 -0.3050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.7808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 0.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9292 -1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2194 -2.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6336 -2.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7660 -0.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0636 1.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.1984 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0285 0.8941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9238 -2.7192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1629 -0.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 1.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.7192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8796 -0.4233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5030 -1.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7827 -1.5692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7793 -2.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0703 -2.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0737 -1.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6032 -0.6691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3642 -0.2336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2264 1.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4653 1.3194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6065 0.5073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4837 -3.1559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6268 0.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1913 1.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3605 -3.1593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7583 -0.7853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5566 -0.7945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6798 1.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 1.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0908 0.0000 H 2 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.4008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 16 1 0 0 0 0 2 18 1 0 0 0 0 3 23 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 12 4 1 6 0 0 0 5 23 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 8 14 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 14 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 13 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 34 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 35 1 0 0 0 0 14 38 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 M ISO 1 43 3 M END $$$$