BBK08D -OEChem-04042104233D 42 44 0 0 0 0 0 0 0999 V2000 -1.0969 0.9059 0.1609 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4225 -1.1521 1.1507 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8029 -1.9024 -0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3846 0.1122 -1.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 0.1787 -0.4931 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9991 1.2830 -0.2806 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8157 -1.5454 -0.2358 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3275 1.4053 -0.1173 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6236 0.0977 -0.0292 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9895 0.9873 0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1354 -0.2774 0.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5067 0.0686 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4353 -1.5160 -0.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5881 -0.6538 0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6817 0.2190 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2719 -0.3253 -0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2855 -2.7945 -0.3726 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0574 -0.0413 0.6983 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7837 -0.6753 -0.1784 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0434 0.0430 -0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4095 0.8713 0.7018 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1924 -0.6225 0.3556 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1023 1.3984 -0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4003 0.0674 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3101 2.0883 -0.2921 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4591 1.4228 0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1692 0.3572 -0.4939 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -1.6617 0.9286 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4899 2.0730 -0.6577 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6957 -3.1427 0.5802 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3903 -3.5722 -0.7444 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -2.6980 -1.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7063 1.0906 0.1676 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 1.8634 0.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7789 1.8706 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5753 0.1888 1.5402 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1681 -1.6769 0.6182 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 1.9504 -0.7692 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2949 -0.4504 0.7925 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3587 3.1417 -0.5525 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4000 1.9596 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9019 -0.2210 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 18 2 0 0 0 0 3 19 2 0 0 0 0 4 27 1 0 0 0 0 4 42 1 0 0 0 0 5 27 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 29 1 0 0 0 0 7 13 1 0 0 0 0 7 16 2 0 0 0 0 8 15 2 0 0 0 0 9 16 1 0 0 0 0 9 19 1 0 0 0 0 9 33 1 0 0 0 0 10 18 1 0 0 0 0 10 21 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 19 20 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 27 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 25 2 0 0 0 0 23 38 1 0 0 0 0 24 26 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M END $$$$