B0HPQ7 -OEChem-04022116393D 41 44 0 0 0 0 0 0 0999 V2000 2.8141 0.9713 -0.3568 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4783 3.7628 -0.4829 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7287 -2.9621 0.0587 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6621 2.3875 0.1476 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5144 -1.1808 0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2695 -2.6430 0.3835 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 -0.7203 -0.2041 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5923 -0.1099 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3877 -3.4835 -0.2631 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9264 -1.6075 -0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7904 -0.2107 0.7629 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1686 1.1156 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8344 -0.3482 -0.1664 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -0.1660 2.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1676 -0.4417 0.2994 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5845 -0.3949 -1.5475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3679 -0.2580 2.5896 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4175 -0.3950 1.6806 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2115 -0.5792 -0.6299 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -0.5319 -2.4566 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3114 3.6151 -0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -0.6238 -1.9986 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 4.8043 0.0325 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2337 -2.8477 1.4608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3041 -2.9362 -0.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3093 -4.5155 0.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2576 -3.5151 -1.3526 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -1.1896 -0.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0699 -1.6752 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4376 -3.5853 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2542 -0.0603 2.8581 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 2.4482 0.4214 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5796 -0.3286 -1.9566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5749 -0.2233 3.6553 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4344 -0.4651 2.0611 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -0.6530 -0.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4275 -0.5671 -3.5223 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7615 -0.7305 -2.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0282 4.8061 1.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 4.7540 -0.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9633 5.7292 -0.1147 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 21 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 30 1 0 0 0 0 4 12 1 0 0 0 0 4 21 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 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 31 1 0 0 0 0 15 18 1 0 0 0 0 15 19 2 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 22 1 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END $$$$