B16GAX -OEChem-04022105293D 54 58 0 0 0 0 0 0 0999 V2000 -5.2492 -1.0067 -0.1868 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1576 2.7262 0.5639 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7715 2.5913 0.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2129 -3.1295 -1.8017 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6486 -3.5610 0.2755 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7558 0.7916 -0.2218 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2745 1.4373 -1.1519 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1184 1.0064 0.3863 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8936 0.8789 0.9199 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -2.7695 -0.6168 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0649 1.8081 -0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 0.3388 -0.8126 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 2.6791 -0.8344 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6225 -0.1135 -0.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5041 2.2249 -0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1227 2.2499 -1.4052 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0574 0.3280 0.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2155 1.7446 -0.1722 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5723 -1.1858 0.0998 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1006 0.0479 0.4501 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3674 0.8145 -0.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6156 1.2683 0.3816 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2929 -2.3731 0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4578 0.1312 0.7927 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1896 -0.5242 -0.3786 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7043 0.4085 0.4989 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2612 -1.4059 -0.2705 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5165 -0.9492 0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6451 -2.2726 0.4038 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2183 -1.0467 0.7635 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6122 -1.8150 0.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8389 -1.3333 0.7172 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9258 0.0104 1.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7967 1.9158 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5624 -0.3123 -0.5562 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6106 0.1908 -1.8813 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5387 2.6344 -1.9035 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0726 3.7278 -0.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3765 -0.1358 1.0628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8615 -1.1400 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3691 2.8219 -0.3378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3383 2.4206 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1076 2.1637 -2.4731 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3683 3.2981 -1.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4178 0.6444 -1.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 -3.3161 -0.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9123 1.0757 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2219 -0.9112 -0.6878 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2643 -3.1664 0.3919 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2727 -1.0065 1.0253 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5393 -2.8727 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6922 2.7344 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6967 -1.9884 0.8143 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8593 0.4437 1.3638 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 19 1 0 0 0 0 2 18 2 0 0 0 0 3 22 1 0 0 0 0 3 52 1 0 0 0 0 4 10 1 0 0 0 0 5 10 2 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 7 16 1 0 0 0 0 7 18 1 0 0 0 0 7 45 1 0 0 0 0 8 17 2 0 0 0 0 8 20 1 0 0 0 0 9 26 1 0 0 0 0 9 33 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 24 2 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 22 26 2 0 0 0 0 23 29 1 0 0 0 0 23 46 1 0 0 0 0 24 30 1 0 0 0 0 24 47 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 26 28 1 0 0 0 0 27 28 2 0 0 0 0 28 31 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 M CHG 2 4 -1 10 1 M END $$$$