BW5T4J -OEChem-04022109482D 106108 0 1 0 0 0 0 0999 V2000 5.4565 -3.5910 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.4285 -0.6022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4437 -0.7758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1885 -0.5910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7250 0.8584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6081 2.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3529 1.2562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1430 0.9299 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7554 0.5112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1733 0.5826 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9805 1.8486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0257 -0.8473 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9997 -3.6664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4177 -3.5949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3004 -5.3721 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6729 -4.7797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 1.1036 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4698 2.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8270 2.8093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8161 -0.1834 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.7705 0.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8009 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3981 -0.2549 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1690 3.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8422 2.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4741 -1.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3225 0.9090 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0561 -1.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1885 0.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 0.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6989 -1.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1169 -1.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3830 -0.0812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 -0.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3569 -2.9003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1017 -1.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7749 -2.8289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6233 2.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9957 2.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3225 -1.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5904 -1.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7445 -2.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2812 3.5544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3225 -2.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5904 -2.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6537 2.9620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4025 -3.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 -2.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6577 -4.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6688 3.1356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3268 4.0753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 4.2490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9696 4.8414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6276 5.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6428 5.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7292 1.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0067 1.7332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8683 2.5182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4376 2.9170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0282 0.3992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7444 1.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7876 -0.3626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7516 3.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3811 4.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5864 3.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7345 3.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2316 2.5280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9498 2.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9372 -0.8131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0756 -1.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9674 1.0938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 1.3075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5192 -0.8846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6576 -1.6695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3854 1.1652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2444 0.9916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8459 0.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2358 -2.2706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0974 -1.4857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8200 -2.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9584 -3.3753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3138 -1.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1643 -2.9365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8594 -0.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0535 -0.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6363 -0.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8137 -1.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3551 -2.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8639 3.7664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0692 4.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6986 3.3423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8594 -2.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0535 -2.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0522 3.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8010 -3.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2703 2.6607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0884 -5.9547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9110 -5.2644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4608 -5.3623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2743 -4.3048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9435 3.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5802 4.7337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 5.2963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0261 6.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4307 6.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 48 1 0 0 0 0 2 21 2 0 0 0 0 3 22 2 0 0 0 0 4 29 2 0 0 0 0 5 33 2 0 0 0 0 6 38 2 0 0 0 0 7 39 2 0 0 0 0 17 8 1 1 0 0 0 8 22 1 0 0 0 0 8 62 1 0 0 0 0 9 21 1 0 0 0 0 23 9 1 6 0 0 0 9 72 1 0 0 0 0 20 10 1 6 0 0 0 10 29 1 0 0 0 0 10 76 1 0 0 0 0 27 11 1 6 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 33 1 0 0 0 0 12 87 1 0 0 0 0 12 88 1 0 0 0 0 13 35 1 0 0 0 0 13 49 2 0 0 0 0 14 37 1 0 0 0 0 14 47 2 0 0 0 0 15 49 1 0 0 0 0 15 98 1 0 0 0 0 15 99 1 0 0 0 0 16 49 1 0 0 0 0 16100 1 0 0 0 0 16101 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 19 60 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 20 61 1 0 0 0 0 23 28 1 0 0 0 0 23 33 1 0 0 0 0 23 63 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 24 66 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 26 32 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 27 73 1 0 0 0 0 28 31 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 30 34 1 0 0 0 0 30 77 1 0 0 0 0 30 78 1 0 0 0 0 31 35 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 36 1 0 0 0 0 32 37 2 0 0 0 0 34 40 2 0 0 0 0 34 41 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 42 2 0 0 0 0 36 83 1 0 0 0 0 37 84 1 0 0 0 0 38 43 1 0 0 0 0 39 46 1 0 0 0 0 40 44 1 0 0 0 0 40 85 1 0 0 0 0 41 45 2 0 0 0 0 41 86 1 0 0 0 0 42 47 1 0 0 0 0 42 89 1 0 0 0 0 43 90 1 0 0 0 0 43 91 1 0 0 0 0 43 92 1 0 0 0 0 44 48 2 0 0 0 0 44 93 1 0 0 0 0 45 48 1 0 0 0 0 45 94 1 0 0 0 0 46 50 2 0 0 0 0 46 95 1 0 0 0 0 47 96 1 0 0 0 0 50 51 1 0 0 0 0 50 97 1 0 0 0 0 51 52 2 0 0 0 0 51 53 1 0 0 0 0 52 54 1 0 0 0 0 52102 1 0 0 0 0 53 55 2 0 0 0 0 53103 1 0 0 0 0 54 56 2 0 0 0 0 54104 1 0 0 0 0 55 56 1 0 0 0 0 55105 1 0 0 0 0 56106 1 0 0 0 0 M END $$$$