B2KUP8 -OEChem-04022107312D 41 45 0 0 0 0 0 0 0999 V2000 3.6730 0.3981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6421 1.8868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4468 0.4930 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -0.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 -2.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 -2.4853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 -2.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 -2.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 0.8981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6139 2.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1139 1.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1139 2.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1139 1.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1139 2.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6139 2.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1016 -2.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 -3.0906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3444 -1.6942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1198 -1.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7212 -0.5020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6383 -0.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3885 -1.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6247 -0.5020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 -1.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5782 -3.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4127 -3.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5188 -2.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 -3.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1361 0.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1806 2.3009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8039 3.4990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4239 0.6931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4239 3.4990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2339 2.0961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 14 1 0 0 0 0 1 36 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 2 37 1 0 0 0 0 3 14 2 0 0 0 0 3 16 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 21 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 22 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 M END $$$$