B1IA4G -OEChem-04012115362D 52 55 0 1 0 0 0 0 0999 V2000 4.5390 2.3701 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.8691 1.8701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8691 3.8701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -0.6299 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.0031 3.3701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -2.1299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 -3.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 -4.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 -3.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 -2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 -2.9680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 -2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 -4.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -3.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -1.1299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 0.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -1.1299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 0.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 1.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 0.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 2.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1371 0.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1371 1.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0031 2.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1016 -3.7609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 -4.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3444 -3.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1198 -2.7203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7212 -2.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6383 -2.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3885 -3.1475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6247 -2.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 -2.7203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5782 -5.0274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4127 -4.8197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -4.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -4.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5188 -3.6701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 -4.6501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4609 -0.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0624 -1.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 0.9527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9284 0.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -1.6668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -1.4399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 -0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 -0.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2711 2.9901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 0.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4662 3.6801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8691 4.4901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 25 2 0 0 0 0 3 5 1 0 0 0 0 3 52 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 25 1 0 0 0 0 5 51 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 6 16 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 26 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 27 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 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 19 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 2 0 0 0 0 21 48 1 0 0 0 0 22 24 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 M END $$$$