B96EFG -OEChem-04022112243D 43 44 0 1 0 0 0 0 0999 V2000 -2.2864 -1.3681 0.7603 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 -2.3611 0.2318 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -1.2415 -1.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1622 1.8772 -0.5709 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7303 0.3582 0.2204 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9489 -0.2932 0.6825 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9813 0.8255 0.7582 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5186 1.8086 -0.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 1.7170 -0.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4773 -0.2160 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3168 -1.3218 -0.3441 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3114 0.6654 -0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.0916 0.2065 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2237 0.7167 -0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5667 0.0263 -0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 0.9438 -0.3262 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0831 0.2763 -0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7234 0.3438 1.1047 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6806 -0.4086 -1.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9616 -0.2733 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9187 -1.0257 -1.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5591 -0.9581 0.2259 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7637 -0.7773 1.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9303 1.3115 1.7402 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0092 0.4882 0.5945 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8693 1.4789 -1.2995 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8865 2.8247 -0.1476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5227 1.9044 -1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5984 2.4140 0.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3265 1.5683 0.6167 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4031 0.9644 -1.0532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0008 -1.0021 -0.4047 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0918 -0.3841 1.2582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5768 -0.8492 -0.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6396 -0.3265 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6991 1.8471 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6663 1.3049 -1.3605 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2199 -3.0453 -0.4248 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2669 0.8727 1.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1905 -0.4698 -2.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -0.2212 2.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3838 -1.5593 -1.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5230 -1.4388 0.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 11 1 0 0 0 0 2 38 1 0 0 0 0 3 11 2 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 M END $$$$