BWRU86 -OEChem-04012119372D 97 98 0 1 0 0 0 0 0999 V2000 7.0468 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 5.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 4.3433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 5.9524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6448 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5109 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7788 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3147 4.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3147 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 5.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2463 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0434 0.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0478 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 4.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3894 4.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 5.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4497 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0669 0.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9138 0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6869 1.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1309 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8909 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 5.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8008 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5608 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0047 0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6247 -0.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9548 5.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3348 6.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2228 6.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6028 5.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8517 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1027 -2.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7042 -3.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 3.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 3.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7778 6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8517 6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -4.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -4.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 3.7368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 6.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 -6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 5.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -6.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4688 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0888 -2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 23 2 0 0 0 0 3 26 2 0 0 0 0 4 31 2 0 0 0 0 5 36 1 0 0 0 0 5 46 1 0 0 0 0 6 36 2 0 0 0 0 14 7 1 1 0 0 0 7 23 1 0 0 0 0 7 57 1 0 0 0 0 18 8 1 6 0 0 0 8 22 1 0 0 0 0 8 58 1 0 0 0 0 16 9 1 1 0 0 0 9 31 1 0 0 0 0 9 65 1 0 0 0 0 10 26 1 0 0 0 0 32 10 1 6 0 0 0 10 78 1 0 0 0 0 33 11 1 6 0 0 0 11 85 1 0 0 0 0 11 86 1 0 0 0 0 12 38 1 0 0 0 0 12 44 1 0 0 0 0 12 89 1 0 0 0 0 13 41 1 0 0 0 0 13 44 2 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 47 1 0 0 0 0 15 17 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 19 1 0 0 0 0 16 23 1 0 0 0 0 16 50 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 17 51 1 0 0 0 0 18 20 1 0 0 0 0 18 26 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 27 1 0 0 0 0 20 28 1 0 0 0 0 20 55 1 0 0 0 0 21 29 1 0 0 0 0 21 30 1 0 0 0 0 21 56 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 24 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 75 1 0 0 0 0 30 76 1 0 0 0 0 30 77 1 0 0 0 0 31 33 1 0 0 0 0 32 34 1 0 0 0 0 32 36 1 0 0 0 0 32 79 1 0 0 0 0 33 35 1 0 0 0 0 33 80 1 0 0 0 0 34 37 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 35 38 1 0 0 0 0 35 83 1 0 0 0 0 35 84 1 0 0 0 0 37 39 2 0 0 0 0 37 40 1 0 0 0 0 38 41 2 0 0 0 0 39 42 1 0 0 0 0 39 87 1 0 0 0 0 40 43 2 0 0 0 0 40 88 1 0 0 0 0 41 90 1 0 0 0 0 42 45 2 0 0 0 0 42 91 1 0 0 0 0 43 45 1 0 0 0 0 43 92 1 0 0 0 0 44 93 1 0 0 0 0 45 94 1 0 0 0 0 46 95 1 0 0 0 0 46 96 1 0 0 0 0 46 97 1 0 0 0 0 M END $$$$