B5CAY3 -OEChem-04022100312D 65 69 0 1 0 0 0 0 0999 V2000 2.0000 -2.5173 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9340 -0.4865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.4827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0583 2.0102 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 16.7942 1.0168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.9827 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7942 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4202 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 2.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4202 0.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1904 2.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3263 0.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9224 2.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0622 1.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7904 2.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9301 0.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 1.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 2.5653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 1.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 0.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 0.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 2.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 2.9576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4131 3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4131 -0.1720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5871 2.9833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7900 2.9802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8620 0.6498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3082 -0.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5482 -0.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3191 2.9900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5221 2.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4512 1.1155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8524 0.4267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4014 1.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0002 2.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3323 0.7089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 0.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 19 2 0 0 0 0 3 24 2 0 0 0 0 7 4 1 1 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 16 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 22 1 0 0 0 0 6 24 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 11 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 12 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 15 17 2 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 23 1 0 0 0 0 20 22 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 24 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 25 27 1 0 0 0 0 25 58 1 0 0 0 0 26 28 2 0 0 0 0 26 59 1 0 0 0 0 27 29 2 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 31 33 1 0 0 0 0 31 62 1 0 0 0 0 32 34 2 0 0 0 0 32 63 1 0 0 0 0 33 35 2 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 M END $$$$