L2HYJ3 -OEChem-05022321452D 93 98 0 1 0 0 0 0 0999 V2000 2.6691 -1.1920 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7218 2.3026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -3.7852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.2852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.7148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1038 2.3026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.7852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -2.7852 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5109 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -5.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -5.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -5.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.7852 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7788 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4128 3.2536 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4128 3.2536 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0006 4.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8250 4.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5938 4.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9951 3.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1816 5.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5829 4.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 0.2093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1762 5.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -2.1652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0434 -1.8103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2463 -1.8103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -3.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9003 -3.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2988 -4.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7754 -1.8103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9784 -1.8103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9784 -4.7602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7754 -4.7602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8535 -2.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4550 -2.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -4.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4550 -4.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8535 -3.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1249 -5.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5234 -5.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4453 -3.3103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6482 -3.3103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6482 -6.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4453 -6.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9687 -3.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5702 -4.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5702 -5.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9687 -5.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 -1.3678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 -0.6775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8347 0.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4362 0.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 0.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 0.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1313 3.8061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8004 3.1566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.1652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3266 4.4271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4606 4.5642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3234 3.6982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 -1.7602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 -1.7602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9772 5.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2473 3.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9295 6.3516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1995 4.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 0.6242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5406 6.1823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 0.9836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -0.5136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 1 44 1 0 0 0 0 2 21 2 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 29 2 0 0 0 0 12 5 1 1 0 0 0 5 15 1 0 0 0 0 5 58 1 0 0 0 0 6 21 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 7 30 1 0 0 0 0 8 30 2 0 0 0 0 8 32 1 0 0 0 0 9 29 1 0 0 0 0 9 35 1 0 0 0 0 9 80 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 21 1 0 0 0 0 12 48 1 0 0 0 0 13 16 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 17 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 15 53 1 0 0 0 0 16 18 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 59 1 0 0 0 0 18 60 1 0 0 0 0 19 22 1 0 0 0 0 19 61 1 0 0 0 0 19 62 1 0 0 0 0 20 23 1 0 0 0 0 20 63 1 0 0 0 0 20 64 1 0 0 0 0 22 24 1 0 0 0 0 22 65 1 0 0 0 0 22 66 1 0 0 0 0 23 24 1 0 0 0 0 23 67 1 0 0 0 0 23 68 1 0 0 0 0 24 69 1 0 0 0 0 24 70 1 0 0 0 0 25 27 1 0 0 0 0 25 29 1 6 0 0 0 25 71 1 0 0 0 0 26 28 1 0 0 0 0 26 72 1 0 0 0 0 26 73 1 0 0 0 0 27 74 1 0 0 0 0 27 75 1 0 0 0 0 28 76 1 0 0 0 0 28 77 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 6 0 0 0 31 78 1 0 0 0 0 32 34 1 6 0 0 0 32 79 1 0 0 0 0 33 36 2 0 0 0 0 33 37 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 38 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 36 39 1 0 0 0 0 36 86 1 0 0 0 0 37 40 2 0 0 0 0 37 87 1 0 0 0 0 38 41 2 0 0 0 0 39 42 2 0 0 0 0 39 88 1 0 0 0 0 40 42 1 0 0 0 0 40 89 1 0 0 0 0 41 43 1 0 0 0 0 41 90 1 0 0 0 0 42 91 1 0 0 0 0 43 44 2 0 0 0 0 43 92 1 0 0 0 0 44 93 1 0 0 0 0 M END $$$$