BIB1E3 -OEChem-04022114333D 40 42 0 0 0 0 0 0 0999 V2000 0.1388 -0.6496 -0.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -2.7525 0.0373 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8065 -2.2661 0.6395 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2381 -0.0245 -0.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7254 0.7397 1.0095 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0385 -1.3492 -0.0123 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8693 -1.4091 -0.1667 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0585 0.7918 -0.8888 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1619 -1.1323 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3577 1.3161 -1.4987 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7786 0.1639 0.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9135 -3.2236 0.5218 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5528 1.1305 -0.5959 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4537 -3.5518 -0.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4538 0.5820 -0.9712 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7028 1.0047 1.2857 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8877 2.1238 0.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 1.8413 -1.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3018 2.2639 1.2493 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 2.6821 0.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9944 1.8712 1.0864 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2974 -0.1522 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7479 1.0056 -1.5968 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1371 1.3187 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0288 -1.0840 -0.8763 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5548 0.8001 -2.4475 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2457 2.3788 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0721 -4.2642 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7016 -3.4907 -1.2674 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2701 -3.1605 0.4078 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2527 -4.5909 0.0686 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -0.0614 -1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1798 0.6938 2.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3262 3.0444 0.3952 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5784 2.1670 -1.9007 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2424 2.9189 2.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4432 3.6626 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 2.5933 1.8212 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -2.0501 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8421 -1.4919 0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 1 25 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 9 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 4 22 1 0 0 0 0 5 21 1 0 0 0 0 5 22 2 0 0 0 0 6 22 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 9 2 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 28 1 0 0 0 0 13 17 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 18 1 0 0 0 0 15 32 1 0 0 0 0 16 19 2 0 0 0 0 16 33 1 0 0 0 0 17 21 2 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$