BB4VQ6 -OEChem-04022108443D 31 33 0 0 0 0 0 0 0999 V2000 -0.3404 2.6943 0.2151 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 0.5854 0.0111 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0536 -1.6483 -0.1101 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3185 0.2018 0.0278 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0379 0.7022 0.0671 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0954 0.3469 -0.0292 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7735 0.3108 0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4837 0.9399 0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2791 -0.9120 -0.0608 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8592 0.9877 -0.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9405 -0.9775 0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 0.3762 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1933 -1.5888 0.4947 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7064 1.0224 0.0904 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3297 2.3058 0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6186 -1.5654 -0.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6425 -0.5758 -0.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1286 -0.5982 -0.0574 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9638 -1.6264 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2123 -0.9809 -0.1202 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7653 1.9850 -0.9435 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1105 -1.5233 0.9843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9503 0.9126 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3117 -2.5916 0.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0726 3.0881 0.2567 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1825 -1.3360 0.7989 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1943 -1.2213 -0.9767 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5248 -2.6530 -0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6619 1.5036 0.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7527 -2.6829 -0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1993 -1.4173 -0.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 6 1 0 0 0 0 2 18 1 0 0 0 0 3 17 2 0 0 0 0 4 8 1 0 0 0 0 4 14 2 0 0 0 0 5 14 1 0 0 0 0 5 17 1 0 0 0 0 5 29 1 0 0 0 0 6 20 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 15 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 11 13 2 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 M END $$$$