B39QVC -OEChem-04042104193D 46 47 0 0 0 0 0 0 0999 V2000 5.5682 1.0547 -0.2798 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4919 1.3232 -0.7285 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6132 -1.5733 -0.0553 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2881 -0.0125 -0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5759 2.4006 -0.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7623 -2.2274 -1.3656 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0296 -2.2799 0.8127 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5229 0.6396 0.1677 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2092 -0.2467 -0.2862 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0186 0.4071 1.0855 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4859 -1.8124 -0.2155 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3240 0.1076 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3056 1.1792 -0.9431 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3888 -0.8658 0.7652 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3653 0.1823 -1.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1349 0.7695 0.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2426 -1.1745 -0.7443 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 0.1814 1.3463 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2135 -0.1304 0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2152 -0.5014 0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8962 0.5683 -0.0858 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5225 -0.7756 -0.0723 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1812 -1.1249 0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5874 1.2135 0.2134 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9285 1.5628 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1947 1.1348 1.3813 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7956 0.9661 1.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7036 -0.3918 2.0208 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6539 1.4459 -1.7815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7765 2.1042 -0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0224 -1.1578 1.6113 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9015 -1.7750 0.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9807 0.6662 -2.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8746 -0.6826 -1.8769 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8975 -1.4607 0.0861 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8183 -2.0867 -1.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8804 -0.6980 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6017 -0.8903 1.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6717 0.7070 2.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6139 1.2510 1.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8947 -2.1745 0.0988 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8627 2.0184 0.2922 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1925 2.6166 0.0522 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2414 1.4428 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6175 1.8717 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1196 0.1498 1.8441 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 21 1 0 0 0 0 1 26 1 0 0 0 0 2 16 2 0 0 0 0 3 20 2 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 16 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 9 17 1 0 0 0 0 10 18 1 0 0 0 0 10 20 1 0 0 0 0 10 40 1 0 0 0 0 11 22 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M CHG 2 6 -1 11 1 M END $$$$