B28DHT -OEChem-04042104453D 33 33 0 0 0 0 0 0 0999 V2000 -4.9082 1.6207 0.9293 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8779 -1.5221 -1.6993 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2977 -2.8734 0.7704 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -0.9175 -0.3976 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8919 -0.1039 -0.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2915 -1.8362 0.1836 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9741 2.6188 -0.6513 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3002 0.0573 0.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0872 -0.3398 0.8723 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3708 -0.4965 0.5286 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5364 1.4668 0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1506 -0.2150 -1.2092 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1721 0.7014 0.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9654 -1.7035 0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4833 0.5813 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 2.0344 0.2672 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1212 -0.7777 -0.1197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3053 1.7049 -0.4003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5983 -0.6899 0.7799 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1958 0.4492 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -1.2474 1.3744 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7903 -0.9017 -0.9406 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 1.6612 1.4872 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2843 2.2298 -0.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 0.5046 -2.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2182 -0.1593 -0.9728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3478 2.0784 -0.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1153 2.8820 0.0457 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0512 2.2251 1.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6851 -2.7722 0.1754 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0184 2.5274 1.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4367 -1.6548 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9453 -3.5927 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 31 1 0 0 0 0 2 12 1 0 0 0 0 2 32 1 0 0 0 0 3 14 1 0 0 0 0 3 33 1 0 0 0 0 4 17 2 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 6 30 1 0 0 0 0 7 18 3 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 M END $$$$