BAB3Y4 -OEChem-04042106253D 41 44 0 0 0 0 0 0 0999 V2000 -5.8552 1.0617 0.8671 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8338 -1.8714 0.0126 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2397 -0.7025 0.5792 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8994 -3.9359 -0.8265 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8037 2.5884 -0.4828 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4456 -2.1699 -0.3763 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6151 -2.9739 -0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5095 -0.6678 0.8578 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0757 0.5764 1.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5679 -1.2742 -0.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9887 -2.8927 0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4722 -1.7782 0.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3787 -3.4432 -0.8887 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 1.7704 0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6689 -1.6493 0.5319 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -0.0328 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7382 0.4580 0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -0.7833 0.6658 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6372 0.8333 -0.7402 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5885 1.9554 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8504 2.6977 0.9679 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3616 3.0676 -1.3477 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6233 3.8097 0.1571 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3791 3.9948 -1.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8686 1.3617 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1501 0.4728 1.6817 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6002 0.7020 2.4718 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6386 -3.7341 -0.1729 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5162 -1.6678 0.8624 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1835 -4.0353 -1.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6976 -2.6119 1.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 0.2754 -1.4828 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5997 -1.0979 1.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5567 1.7798 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3575 1.2405 -0.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2522 2.5652 1.8654 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 3.2117 -2.2492 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8575 4.5311 0.4266 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2022 4.8606 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0409 2.9133 -1.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5771 3.2400 -0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 2 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 3 8 2 0 0 0 0 4 7 2 0 0 0 0 4 13 1 0 0 0 0 5 25 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 10 1 0 0 0 0 6 13 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 18 1 0 0 0 0 15 31 1 0 0 0 0 16 19 2 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$