B36KYA -OEChem-04012113313D 42 44 0 1 0 0 0 0 0999 V2000 -2.2090 0.2715 1.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2797 -0.7100 0.7645 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1187 2.5293 -1.2386 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 0.6298 0.6324 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9387 2.1752 0.4587 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8133 2.5550 -0.5296 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3801 0.4073 0.4101 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6833 -0.1956 -0.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1898 1.4900 -0.2399 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2943 2.7144 0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4352 -1.6918 -0.1694 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5273 1.4393 -0.5649 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 0.2975 -0.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2873 -2.5160 -1.1342 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5923 -0.7616 0.4612 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6286 0.1927 -0.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -4.0075 -0.9346 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3343 -1.8867 0.8062 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3434 -0.9467 -0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -1.9861 0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7076 2.6396 1.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4362 3.5595 -0.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 2.4921 -1.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4557 0.0876 -1.3872 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7517 -0.0075 -0.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5694 2.3641 -0.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0792 2.4103 0.7195 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2765 3.8092 -0.0094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -1.9526 -0.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6565 -1.9966 0.8601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1388 0.5201 2.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0421 -2.2507 -2.1692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3486 -2.2867 -0.9831 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5504 3.3263 -1.4938 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0898 2.5304 -1.5106 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1813 0.9755 -1.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3387 -4.3108 0.0822 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -4.2788 -1.1094 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6898 -4.5775 -1.6338 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8519 -2.7164 1.3198 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4016 -1.0230 -0.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2474 -2.8780 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 31 1 0 0 0 0 2 7 2 0 0 0 0 2 15 1 0 0 0 0 3 12 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 21 1 0 0 0 0 6 9 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 8 11 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 12 2 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 14 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 M END $$$$