BPIH31 -OEChem-04042107003D 41 42 0 0 0 0 0 0 0999 V2000 4.2500 0.7767 -0.9701 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6114 -1.6652 -0.3032 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5163 0.9281 2.1062 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0776 0.6729 -0.1785 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0433 -3.8923 0.3112 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0236 -2.9470 0.2799 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0534 3.1046 -1.2072 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4128 -0.3403 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9976 -0.0789 -0.3445 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.5927 -0.6955 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1311 0.4967 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6957 0.0049 -0.6724 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9052 -1.6055 -0.1729 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5842 0.3027 0.8622 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7815 -0.2072 -1.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9546 0.5561 0.9222 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7385 0.4278 -0.2244 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1519 0.0460 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6487 1.4940 1.6433 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6336 0.6120 0.3697 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.8145 0.1474 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2308 1.9807 -0.9783 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6456 1.0362 3.2308 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8066 0.5188 -1.3949 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9361 -0.5172 0.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9276 0.3872 1.7226 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5039 -2.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8308 2.5298 1.3346 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1781 1.3374 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5792 1.3794 1.8505 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9176 1.6104 0.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1765 0.4263 1.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9838 -0.1240 -0.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6977 -0.0738 -2.3605 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2595 1.3409 4.0849 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8935 1.8192 3.0857 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1989 0.0702 3.4902 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 1.2320 -2.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7808 -0.5163 -1.7525 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8534 0.7528 -1.1749 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5412 -4.7063 0.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 16 1 0 0 0 0 3 23 1 0 0 0 0 4 17 1 0 0 0 0 4 24 1 0 0 0 0 5 21 1 0 0 0 0 5 41 1 0 0 0 0 6 21 2 0 0 0 0 7 22 3 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 12 2 0 0 0 0 10 22 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 11 25 1 0 0 0 0 13 21 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 15 18 2 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$