BENB07 -OEChem-04022113013D 44 47 0 0 0 0 0 0 0999 V2000 2.2828 2.4020 -0.1134 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3162 1.1796 -0.0542 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6867 -0.1315 0.0122 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6079 -2.5230 0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6607 -1.3956 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9267 -1.1587 0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5162 0.0551 -0.0132 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4527 -1.2361 0.0514 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -0.0881 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6989 1.3171 -0.0649 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9716 0.1823 -0.0248 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6899 -2.4613 0.0938 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2615 -2.4301 0.1078 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5086 2.3845 -0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -1.3496 0.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6613 0.1913 -1.2372 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6715 0.2946 1.1764 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0509 0.3126 -1.2483 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 0.4160 1.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7507 0.4249 -0.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6471 -0.3921 0.0381 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -0.6538 -0.5489 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3864 0.8640 0.5855 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8624 0.3407 -0.5886 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3636 1.8585 0.5459 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6017 1.5968 -0.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4379 -3.0873 -0.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4474 -3.0098 1.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7764 -2.3450 0.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -3.3962 0.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1163 2.4394 0.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1576 2.3390 -0.9854 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0969 3.2924 -0.1702 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1302 0.1050 -2.1821 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1483 0.2896 2.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -2.3414 -0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 0.3196 -2.1923 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 0.5035 2.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8326 0.5193 -0.0555 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1006 -1.6283 -0.9797 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4556 1.0975 1.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8265 0.1370 -1.0453 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1648 2.8336 0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3634 2.3705 -0.0699 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 2 14 1 0 0 0 0 3 9 2 0 0 0 0 3 15 1 0 0 0 0 4 13 1 0 0 0 0 4 15 2 0 0 0 0 5 15 1 0 0 0 0 5 21 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 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 14 33 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 19 2 0 0 0 0 17 35 1 0 0 0 0 18 20 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$