BE2B1L -OEChem-04012112442D 60 63 0 1 0 0 0 0 0999 V2000 4.2690 1.8988 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3793 -0.1552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0735 0.2049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9146 1.4921 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5837 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0837 3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1056 2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 0.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2815 -0.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2325 -1.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5383 -1.4424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4404 -2.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7462 -2.4205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9757 -0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5873 -1.1334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3915 -2.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0031 -3.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9267 -0.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8441 -1.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1346 -1.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 -2.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4328 1.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9986 1.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0853 2.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6501 3.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8921 3.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0408 3.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4856 2.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5343 0.6197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6918 -0.5817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 0.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 -0.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9797 -2.4753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3359 -2.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8468 0.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4584 -0.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5204 -2.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 -3.6961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3875 -0.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -1.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7243 -1.8919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5913 -3.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 11 2 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 3 12 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 40 1 0 0 0 0 5 12 1 0 0 0 0 5 16 1 0 0 0 0 5 42 1 0 0 0 0 6 26 1 0 0 0 0 6 59 1 0 0 0 0 6 60 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 1 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 41 1 0 0 0 0 14 18 2 0 0 0 0 14 20 1 0 0 0 0 15 19 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 26 1 0 0 0 0 17 27 2 0 0 0 0 18 22 1 0 0 0 0 18 45 1 0 0 0 0 19 23 1 0 0 0 0 19 46 1 0 0 0 0 20 24 2 0 0 0 0 20 47 1 0 0 0 0 21 25 2 0 0 0 0 21 48 1 0 0 0 0 22 28 2 0 0 0 0 22 49 1 0 0 0 0 23 29 2 0 0 0 0 23 50 1 0 0 0 0 24 28 1 0 0 0 0 24 51 1 0 0 0 0 25 29 1 0 0 0 0 25 52 1 0 0 0 0 26 30 2 0 0 0 0 27 31 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 32 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 M END $$$$