B54EPU -OEChem-04022101022D 73 74 0 1 0 0 0 0 0999 V2000 3.3328 5.2563 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4924 -5.4118 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 2.0882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2564 2.8888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 1.0882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6637 4.5131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0019 5.9994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 -4.9118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6263 -5.9118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9924 -6.2779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9924 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 3.5882 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7212 4.5360 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0904 1.0882 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 5.9254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4154 4.1759 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7244 5.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7244 5.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0334 4.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 2.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0904 2.0882 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.4644 3.8669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9565 2.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8225 2.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7702 4.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6885 2.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8225 1.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 4.8962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 0.5881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0759 4.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 -0.4119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 -0.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 -1.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 -2.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4924 -2.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2244 -3.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4924 -3.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3584 -3.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3184 3.5636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7892 5.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1180 5.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3309 5.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6596 5.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3434 3.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5998 4.4281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6274 1.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3550 3.0631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5579 3.0631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3594 1.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8501 5.1425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6274 0.7781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2816 3.8453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0612 3.6796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9985 2.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2255 2.8981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3785 3.1251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2025 1.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8225 0.4681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4425 1.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5156 5.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7359 5.4436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5874 4.2054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 4.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7614 -0.7219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8215 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.7338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7186 6.5319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7614 -2.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9554 -2.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7614 -3.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9554 -3.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6263 -6.5319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6124 -6.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 15 1 0 0 0 0 1 30 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 2 11 2 0 0 0 0 3 20 2 0 0 0 0 4 22 2 0 0 0 0 5 29 2 0 0 0 0 8 38 1 0 0 0 0 9 72 1 0 0 0 0 10 73 1 0 0 0 0 12 16 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 22 1 0 0 0 0 13 25 1 0 0 0 0 13 50 1 0 0 0 0 21 14 1 6 0 0 0 14 29 1 0 0 0 0 14 51 1 0 0 0 0 15 66 1 0 0 0 0 15 67 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 6 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 24 49 1 0 0 0 0 25 28 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 30 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 34 68 1 0 0 0 0 35 37 2 0 0 0 0 35 69 1 0 0 0 0 36 38 2 0 0 0 0 36 70 1 0 0 0 0 37 38 1 0 0 0 0 37 71 1 0 0 0 0 M END $$$$