B4EB3I -OEChem-04012113322D 33 35 0 1 0 0 0 0 0999 V2000 5.9061 -1.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1132 0.3645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3733 -0.8956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2943 2.0870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3179 0.7517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 -0.8956 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -0.5355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -1.1744 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4223 -0.5866 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8042 -0.5866 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3204 -1.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 0.3645 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6132 -2.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7010 1.1735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -0.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -1.8738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -2.1828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -1.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5192 -1.1990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3658 -0.1482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7588 -2.3199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7588 -1.4431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8318 0.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1748 -3.0270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0516 -3.0270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1317 0.7275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2150 1.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8341 -0.4808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -2.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6587 2.5886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6982 -0.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5653 -2.7892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9 1 1 6 0 0 0 1 14 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 10 3 1 1 0 0 0 3 29 1 0 0 0 0 4 15 1 0 0 0 0 4 31 1 0 0 0 0 5 16 2 0 0 0 0 6 19 2 0 0 0 0 11 7 1 6 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 16 1 0 0 0 0 8 19 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 15 1 6 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 M END $$$$