B3I6WN -OEChem-04012117072D 56 59 0 1 0 0 0 0 0999 V2000 7.7820 1.5983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0286 0.3429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4284 1.0603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5251 -0.6569 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5251 0.3431 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6591 -1.1569 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7931 -0.6569 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8831 -1.1638 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6591 0.8431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7931 0.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4714 0.6478 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4714 -0.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6752 -2.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0550 -0.1569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 -2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7771 -2.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5251 1.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9562 -0.5997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8908 -0.1638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0084 -1.1276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9396 -2.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7605 1.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0712 2.7551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5908 -1.2734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1984 -1.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 -0.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0576 1.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2606 1.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 0.9257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1825 0.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0838 0.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2203 -1.5286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0087 -1.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8932 -2.7788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2843 -2.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5158 -0.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5158 0.2578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 -3.2021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1781 -3.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1451 1.3431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5251 1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9051 1.3431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3645 -0.1330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5663 -0.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5005 -0.2762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1073 0.4172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8038 -0.5423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3967 -1.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -3.3751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -2.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7864 -2.7946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0334 0.9629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6605 2.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2638 3.3444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4819 2.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 23 1 0 0 0 0 2 19 1 0 0 0 0 2 53 1 0 0 0 0 3 23 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 4 25 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 14 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 16 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 20 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 22 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 M END $$$$