B5Y8WU -OEChem-04012114472D 43 46 0 1 0 0 0 0 0999 V2000 4.5274 3.2894 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0864 -0.5211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4323 -2.8239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 1.7505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 2.9338 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 0.9658 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7328 1.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 1.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3923 0.0184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 2.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 2.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 2.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 0.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0528 -0.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4118 -0.1782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0321 2.3768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 0.6329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 2.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 1.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7328 -1.6799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0919 -1.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7524 -1.8764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -0.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1227 0.5011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 0.3784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6607 -0.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0023 0.2873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1633 1.7709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 2.5081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9008 2.9828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9051 0.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 1.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 3.5257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 0.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1423 -2.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -1.2475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 2.2964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -0.5259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4574 -0.5751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5066 0.3003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8419 -3.2894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 13 2 0 0 0 0 3 24 1 0 0 0 0 3 43 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 26 1 0 0 0 0 7 11 2 0 0 0 0 7 13 1 0 0 0 0 8 12 1 0 0 0 0 8 14 2 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 11 17 1 0 0 0 0 12 19 2 0 0 0 0 13 18 1 0 0 0 0 14 20 1 0 0 0 0 14 27 1 0 0 0 0 15 21 1 0 0 0 0 15 28 1 0 0 0 0 16 22 2 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 25 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 23 1 0 0 0 0 19 35 1 0 0 0 0 20 23 2 0 0 0 0 20 36 1 0 0 0 0 21 24 2 0 0 0 0 21 37 1 0 0 0 0 22 24 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$