L1X3QR -OEChem-05032300462D 82 86 0 1 0 0 0 0 0999 V2000 8.0622 -5.6471 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.1603 3.9151 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.1603 2.1830 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.1603 -1.2811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.1471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6603 1.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1603 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.6471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -4.1471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6603 -0.4151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1962 -2.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.6471 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6603 -2.1471 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9282 -2.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1603 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1603 -1.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1603 0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1603 0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6603 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1603 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.1471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6603 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1603 3.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6603 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6603 4.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1603 3.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6603 4.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1603 5.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0357 -2.7460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1711 -0.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2212 -0.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6135 -1.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0885 -2.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 -2.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 -3.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 -4.2297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 -2.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 -2.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -4.2297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -3.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 -4.2297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 -3.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -4.7671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5402 -1.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0403 -0.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4703 -1.8180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.0271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8503 0.9879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -5.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -3.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -3.1722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -4.6221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -4.6221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5526 0.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2429 1.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2679 2.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5776 2.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.6102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -4.6840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3503 5.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7803 3.9151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6972 5.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4703 6.1840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6233 5.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 16 4 1 6 0 0 0 4 60 1 0 0 0 0 5 17 2 0 0 0 0 6 31 1 0 0 0 0 6 35 1 0 0 0 0 7 34 1 0 0 0 0 7 37 1 0 0 0 0 8 36 1 0 0 0 0 8 38 1 0 0 0 0 9 12 1 0 0 0 0 9 17 1 0 0 0 0 9 20 1 0 0 0 0 10 18 1 0 0 0 0 10 21 1 0 0 0 0 10 59 1 0 0 0 0 11 25 1 0 0 0 0 11 31 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 6 0 0 0 15 18 1 0 0 0 0 15 50 1 0 0 0 0 16 19 1 0 0 0 0 16 22 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 23 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 24 1 0 0 0 0 22 25 2 0 0 0 0 23 26 1 0 0 0 0 23 27 2 0 0 0 0 24 28 2 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 26 29 2 0 0 0 0 26 63 1 0 0 0 0 27 30 1 0 0 0 0 28 31 1 0 0 0 0 28 64 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 30 32 2 0 0 0 0 30 65 1 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 36 73 1 0 0 0 0 36 74 1 0 0 0 0 37 75 1 0 0 0 0 37 76 1 0 0 0 0 37 77 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 40 42 2 0 0 0 0 41 43 2 0 0 0 0 41 78 1 0 0 0 0 42 43 1 0 0 0 0 42 79 1 0 0 0 0 43 44 1 0 0 0 0 44 80 1 0 0 0 0 44 81 1 0 0 0 0 44 82 1 0 0 0 0 M END $$$$