EXO1961 -OEChem-04222010013D 39 41 0 0 0 0 0 0 0999 V2000 0.1449 0.5356 1.3861 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7235 0.7751 2.8698 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7966 -1.3046 1.4029 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.2368 -1.3841 0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -0.0999 -2.0639 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2803 1.1879 0.6946 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3955 0.1938 0.1556 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 0.3521 -0.3135 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7811 -0.0122 -0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3822 0.5881 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4439 0.1363 -0.8755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0163 0.3831 -1.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9092 0.4530 1.4415 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1684 -0.5054 -0.2403 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4788 -0.3083 0.1956 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9063 1.8788 -0.5297 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6287 -0.5699 0.7944 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2668 0.3484 -1.4108 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0027 0.9824 0.2689 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2164 2.0759 -0.0938 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9755 -0.7687 0.4905 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6134 0.1496 -1.7148 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4678 -0.4092 -0.7642 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4411 -1.5966 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7325 -3.0812 -0.2364 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9379 0.2502 -2.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7688 -1.5159 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3062 2.7414 -0.8096 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2903 -0.9868 1.7339 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6677 0.8522 -2.1611 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 3.0867 -0.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0013 0.4447 -2.6854 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5171 -0.5606 -0.9992 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2683 -1.0893 0.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3562 -1.2090 -1.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6595 -3.2799 -0.7815 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 -3.6180 -0.7258 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8224 -3.4917 0.7749 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4700 2.1416 0.6788 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 2 13 2 0 0 0 0 3 21 1 0 0 0 0 4 15 1 0 0 0 0 4 24 1 0 0 0 0 5 11 2 0 0 0 0 6 19 1 0 0 0 0 6 39 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 3 0 0 0 9 17 2 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 16 20 2 0 0 0 0 16 28 1 0 0 0 0 17 21 1 0 0 0 0 17 29 1 0 0 0 0 18 22 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 20 31 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$