D0RK4K -OEChem-10101305022D 45 48 0 0 0 0 0 0 0999 V2000 5.4050 -0.0699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8691 1.9301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0031 0.4301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -0.0699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 1.4301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -1.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 -2.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 -2.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 -2.9533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 -1.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 -1.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 -1.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 -3.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 0.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 1.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 2.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1371 1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 3.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1371 2.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0031 1.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 -3.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1016 -2.7009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8912 -3.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1198 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7212 -0.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6247 -0.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6383 -1.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3885 -2.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -3.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -3.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5782 -3.9674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4127 -3.7597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5188 -2.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 -3.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1361 0.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0021 1.7401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 0.8101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8681 3.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 4.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 3.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4061 1.6201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 23 1 0 0 0 0 2 45 1 0 0 0 0 3 23 2 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 4 39 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 5 40 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 25 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 26 1 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 24 1 0 0 0 0 10 27 1 0 0 0 0 10 28 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 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 M END $$$$