B1YGH3 -OEChem-04022100342D 57 60 0 1 0 0 0 0 0999 V2000 6.8401 -3.7239 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6669 -2.7390 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 3.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 3.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 -0.9094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3307 -0.3164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2732 -2.7885 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.6730 2.3743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 0.9260 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8368 0.9260 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9819 0.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 0.6232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5092 1.8915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8368 1.8915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9819 1.5362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 3.3743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9731 -1.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6307 -2.0222 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6459 -2.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2581 -2.6152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9308 -3.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9006 -3.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5733 -4.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5582 -4.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3036 -3.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1016 0.7433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3444 1.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 -0.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1113 0.3608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1198 1.7839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7212 2.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6247 2.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 1.7839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6383 2.0522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3885 1.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5782 -0.5232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4127 -0.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5188 0.8341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8068 -0.1459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -0.4238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2413 -1.9148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 4.4943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6462 -1.5755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0354 -2.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7951 -2.3054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0463 -2.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.4178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5321 -4.2028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0363 -4.8041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7851 -5.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -4.9411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1687 -4.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -2.9228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0913 -3.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8861 -3.3473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 24 1 0 0 0 0 3 18 1 0 0 0 0 3 44 1 0 0 0 0 4 18 2 0 0 0 0 5 19 2 0 0 0 0 6 12 1 0 0 0 0 6 19 1 0 0 0 0 6 42 1 0 0 0 0 7 20 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 17 1 0 0 0 0 10 29 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 27 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 24 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 26 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 M END $$$$