D0N8DP -OEChem-04152108583D 37 40 0 0 0 0 0 0 0999 V2000 -2.7606 1.2385 0.9336 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0122 -3.5755 0.2643 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7396 -1.3286 0.6107 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2118 -2.2314 -0.8696 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4589 1.4219 -0.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 2.0749 -0.7934 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5101 3.5486 -1.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1768 4.2864 0.0083 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5505 3.6812 0.3281 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4914 2.1848 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7273 0.0057 -0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0011 -0.1846 0.4178 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1791 -1.1085 -0.3728 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6108 -0.9733 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5927 -2.4179 -1.2726 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4802 -2.5098 -0.0519 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9821 -0.7614 1.3116 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5873 -1.0595 -1.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3302 -0.6358 1.6473 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9354 -0.9339 -0.6726 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3068 -0.7219 0.6551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5784 2.0197 -0.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0791 1.5428 -1.6966 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4629 4.0336 -1.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1195 3.6130 -2.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2931 5.3477 -0.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4637 4.2339 0.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2739 4.0113 -0.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8948 4.0540 1.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5169 -1.2805 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6718 -3.3622 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9427 -1.6348 -1.9556 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2329 -0.6970 2.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3108 -1.2211 -2.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6195 -0.4716 2.6812 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6958 -1.0000 -1.4452 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3564 -0.6239 0.9163 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 16 2 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 3 30 1 0 0 0 0 4 13 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 M END $$$$