B2CE7W -OEChem-04012118352D 48 52 0 0 0 0 0 0 0999 V2000 3.6180 1.4454 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2212 1.6666 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2698 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7644 -3.5011 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0847 -2.9943 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2576 -2.1808 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.8747 3.5011 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.8747 3.5011 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9672 2.6758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6128 2.2691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2981 1.9326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6128 1.2691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2911 2.5738 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2911 0.9643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3913 0.1531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7468 2.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7981 1.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8807 2.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3968 0.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7762 1.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3448 2.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9791 -0.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4788 2.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9901 -0.8650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5778 -1.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3448 1.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5724 -1.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8747 1.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4788 0.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8747 1.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1711 -2.5876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3747 2.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3747 0.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3747 2.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3747 0.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8747 1.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1453 3.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3482 3.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 0.8597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5957 -0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4788 3.3891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3735 -0.9298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9368 -2.0711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4788 0.1491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0647 0.3661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6847 0.3661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4947 1.7691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 35 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 10 23 1 0 0 0 0 11 17 2 0 0 0 0 12 30 2 0 0 0 0 13 21 1 0 0 0 0 13 29 2 0 0 0 0 14 26 2 0 0 0 0 14 29 1 0 0 0 0 15 17 1 0 0 0 0 15 19 2 0 0 0 0 15 22 1 0 0 0 0 16 18 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 20 1 0 0 0 0 18 20 2 0 0 0 0 19 24 1 0 0 0 0 19 28 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 26 1 0 0 0 0 22 27 2 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 26 30 1 0 0 0 0 27 44 1 0 0 0 0 29 31 1 0 0 0 0 30 45 1 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 33 35 1 0 0 0 0 34 36 2 0 0 0 0 34 46 1 0 0 0 0 35 37 2 0 0 0 0 36 37 1 0 0 0 0 36 47 1 0 0 0 0 37 48 1 0 0 0 0 M END $$$$