B0SCZ1 -OEChem-04012116462D 54 56 0 1 0 0 0 0 0999 V2000 11.5263 -1.3877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0183 -1.4223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7885 -1.4118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.8877 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.0622 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -1.3877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 0.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0183 0.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 0.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9244 -0.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -0.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -0.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 -0.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 -0.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 0.6949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 0.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.1977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -2.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8554 0.4223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0111 1.2670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4601 0.4452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.4223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.6493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 15 1 0 0 0 0 2 22 1 0 0 0 0 2 28 1 0 0 0 0 3 19 1 0 0 0 0 3 29 1 0 0 0 0 4 28 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 10 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 12 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 11 18 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 16 1 0 0 0 0 13 42 1 0 0 0 0 14 17 2 0 0 0 0 14 43 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 19 2 0 0 0 0 16 44 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 18 27 3 0 0 0 0 20 22 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 28 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END $$$$