B1XNI5 -OEChem-04012113112D 45 48 0 0 0 0 0 0 0999 V2000 10.3914 -1.3442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 0.1553 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 2.2247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 0.6692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 1.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 0.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 0.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7953 -0.8341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 0.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6594 -1.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5273 -0.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2593 -0.8475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -2.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -2.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -2.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -2.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 2.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6694 1.2825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2571 -1.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0693 0.4671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 -1.9575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5673 -1.3856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7975 -0.5396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9514 -0.3094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 13 2 0 0 0 0 3 16 1 0 0 0 0 4 14 2 0 0 0 0 4 17 1 0 0 0 0 5 15 1 0 0 0 0 5 16 2 0 0 0 0 6 15 2 0 0 0 0 6 18 1 0 0 0 0 7 16 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$