L5H3KJ -OEChem-05022323472D 52 55 0 0 0 0 0 0 0999 V2000 9.8500 3.8152 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.3466 4.6793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3533 2.9512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0604 -4.2669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9859 3.3119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3936 1.8019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4994 0.2742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2995 0.2811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7032 -0.9626 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1196 -1.7674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4141 -3.7288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2577 2.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2538 3.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1256 1.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1179 3.8086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9897 2.3119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3974 0.8019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7141 4.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5155 -0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6494 -1.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 -1.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6494 -2.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2915 -0.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 -2.2674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5155 -2.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7032 -2.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 -0.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3926 -3.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1034 -4.6793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7196 2.6132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0395 3.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6437 3.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7289 1.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 1.3352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5146 4.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7176 4.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2040 1.7301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5999 2.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8555 2.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0261 3.7828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2498 4.6306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4020 4.8543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8248 -1.0767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9184 -2.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5155 -3.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9819 0.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 0.5772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8032 -0.2047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5141 -4.4867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9108 -5.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6927 -4.8720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 18 1 0 0 0 0 4 28 2 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 6 39 1 0 0 0 0 7 17 1 0 0 0 0 7 19 2 0 0 0 0 8 17 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 27 1 0 0 0 0 10 26 2 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 22 25 1 0 0 0 0 22 26 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END $$$$