B8ODP7 -OEChem-04022100402D 49 51 0 1 0 0 0 0 0999 V2000 2.8660 0.6909 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3091 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.8091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0296 2.1524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3833 2.6904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.3091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.6909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 -0.6138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3241 0.1909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.6909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8091 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1962 -0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7404 0.9956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0511 1.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3403 3.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3188 3.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 1.2735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 0.5832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -1.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -1.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.1658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 0.1658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.1658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 0.1658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3197 3.7226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7265 3.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4466 2.7024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9255 3.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1909 3.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 24 1 0 0 0 0 3 17 2 0 0 0 0 4 21 1 0 0 0 0 4 27 1 0 0 0 0 5 21 2 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 16 9 1 6 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 18 1 0 0 0 0 16 37 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 26 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END $$$$