D0PF3J -OEChem-04152110392D 123125 0 1 0 0 0 0 0999 V2000 4.5411 -0.6571 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.2449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5995 0.5963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4405 -0.6909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1958 0.8542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0764 4.4578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9757 -2.3382 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5016 1.2143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6116 2.8105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9785 5.0758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -0.6571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.7449 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1667 -3.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.2449 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1448 -3.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -3.0813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.7449 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2937 0.2361 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1836 -1.3600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3426 -0.0729 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1347 -1.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0368 -0.4330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3301 -3.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9879 -0.1240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8289 -1.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4526 1.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6605 2.5015 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7584 1.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7310 -0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9174 3.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2449 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8074 1.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1253 4.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9663 2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7706 4.0976 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.8195 3.7886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5137 3.4285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4648 3.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3058 2.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9295 5.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2353 5.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 0.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1067 -1.8961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 -3.7394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1019 -4.3560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -1.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9533 -4.5370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 -4.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1464 -3.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0597 -2.6206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.0549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8833 0.4277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7530 -0.2645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2210 -1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7543 -1.0727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4471 -0.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 -3.7449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 -3.7449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4764 0.2577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6968 0.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2224 -1.2822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7000 -2.0176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4353 -1.5400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7894 3.1079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1733 2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2977 2.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3436 1.4227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 -0.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -0.4349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -1.2818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3161 -1.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1918 -1.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1459 -0.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7885 2.5641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4138 1.4455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9363 2.1809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2009 1.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0723 2.3956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7318 4.0198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2542 4.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5189 4.2776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7747 3.4512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3767 2.6700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1579 2.2719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.1623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -2.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3098 4.5125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6426 4.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6564 3.1479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0544 3.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2732 4.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6993 2.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1769 1.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9122 2.3215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1211 4.7951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5192 5.5764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7379 5.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6502 6.2057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7746 6.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8205 5.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 0.7955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8676 0.7955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.5549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.5549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 42 1 0 0 0 0 1 51 1 0 0 0 0 16 2 1 1 0 0 0 2 32 1 0 0 0 0 22 3 1 1 0 0 0 3 36 1 0 0 0 0 4 21 2 0 0 0 0 5 26 2 0 0 0 0 6 29 2 0 0 0 0 7 41 2 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 8 21 1 0 0 0 0 20 9 1 1 0 0 0 9 29 1 0 0 0 0 9 31 1 0 0 0 0 10 26 1 0 0 0 0 35 10 1 1 0 0 0 10 85 1 0 0 0 0 30 11 1 6 0 0 0 11 41 1 0 0 0 0 11 94 1 0 0 0 0 40 12 1 1 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 42 2 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 56 1 6 0 0 0 15 17 1 0 0 0 0 15 57 1 0 0 0 0 15 58 1 0 0 0 0 16 19 1 0 0 0 0 16 59 1 0 0 0 0 17 18 1 0 0 0 0 17 60 1 0 0 0 0 17 61 1 0 0 0 0 18 62 1 0 0 0 0 18 63 1 0 0 0 0 19 25 1 1 0 0 0 19 26 1 0 0 0 0 19 64 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 20 65 1 0 0 0 0 21 23 1 0 0 0 0 22 23 1 0 0 0 0 22 66 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 24 27 1 0 0 0 0 24 28 1 6 0 0 0 24 69 1 0 0 0 0 25 70 1 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 27 33 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 28 75 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 29 30 1 0 0 0 0 30 34 1 0 0 0 0 30 78 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 32 82 1 0 0 0 0 32 83 1 0 0 0 0 32 84 1 0 0 0 0 33 86 1 0 0 0 0 33 87 1 0 0 0 0 33 88 1 0 0 0 0 34 37 1 0 0 0 0 34 38 1 0 0 0 0 34 89 1 0 0 0 0 35 39 1 0 0 0 0 35 42 1 0 0 0 0 35 90 1 0 0 0 0 36 91 1 0 0 0 0 36 92 1 0 0 0 0 36 93 1 0 0 0 0 37 95 1 0 0 0 0 37 96 1 0 0 0 0 37 97 1 0 0 0 0 38 98 1 0 0 0 0 38 99 1 0 0 0 0 38100 1 0 0 0 0 39 44 1 0 0 0 0 39101 1 0 0 0 0 39102 1 0 0 0 0 40 41 1 0 0 0 0 40 43 1 0 0 0 0 40103 1 0 0 0 0 43 45 1 0 0 0 0 43 46 1 0 0 0 0 43104 1 0 0 0 0 44 49 2 0 0 0 0 44 50 1 0 0 0 0 45105 1 0 0 0 0 45106 1 0 0 0 0 45107 1 0 0 0 0 46108 1 0 0 0 0 46109 1 0 0 0 0 46110 1 0 0 0 0 47111 1 0 0 0 0 47112 1 0 0 0 0 47113 1 0 0 0 0 48114 1 0 0 0 0 48115 1 0 0 0 0 48116 1 0 0 0 0 49 53 1 0 0 0 0 49117 1 0 0 0 0 50 54 2 0 0 0 0 50118 1 0 0 0 0 51 52 2 0 0 0 0 51119 1 0 0 0 0 52120 1 0 0 0 0 53 55 2 0 0 0 0 53121 1 0 0 0 0 54 55 1 0 0 0 0 54122 1 0 0 0 0 55123 1 0 0 0 0 M END $$$$