B6GXK2 -OEChem-04012117542D 56 59 0 1 0 0 0 0 0999 V2000 8.5179 2.5489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5357 -2.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4586 0.0493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9288 0.5493 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9288 -0.4507 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0628 -0.9507 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1968 -0.4507 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2868 -0.9575 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8750 0.8540 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0628 1.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1968 0.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8750 -0.7554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4586 0.0493 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0789 -1.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2787 -1.9991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9288 1.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3599 -0.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.5200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2945 0.0424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3433 -2.5489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1857 1.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -0.9214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4037 -2.0064 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4586 0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1642 2.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0188 -1.2959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8022 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9329 -0.0257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4875 0.9502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4613 1.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6643 1.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9847 1.1319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5862 0.4416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6240 -1.3223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4124 -1.0647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7404 -0.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2969 -2.5726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -1.8767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5488 1.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9288 2.1693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3088 1.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7681 0.0732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 0.0886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1832 -3.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9145 0.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2993 0.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6745 0.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -3.0248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7443 -3.0218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2075 -0.3361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8004 -1.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4025 -2.6264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2921 1.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7709 2.1386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0364 2.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 23 1 0 0 0 0 2 56 1 0 0 0 0 3 24 3 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 16 1 1 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 26 1 6 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 27 1 1 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 28 1 6 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 8 19 1 1 0 0 0 9 13 1 0 0 0 0 9 21 1 1 0 0 0 9 29 1 0 0 0 0 10 11 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 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 24 1 6 0 0 0 13 36 1 0 0 0 0 14 18 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 18 2 0 0 0 0 15 20 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 22 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 23 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 M END $$$$