B5UJC2 -OEChem-04022113113D 33 35 0 0 0 0 0 0 0999 V2000 1.8094 -0.7116 -0.1637 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7429 2.3183 -0.2804 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6901 -1.5997 -1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2791 -1.1181 1.1236 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1892 0.8162 -0.6117 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1091 0.0871 -0.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5341 -0.3731 0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2946 0.7493 -0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2326 1.0626 -0.4052 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5712 0.1090 0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 0.0232 1.2912 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4062 -0.5020 -1.0352 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0768 2.1043 -0.1061 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7186 0.8786 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6645 -1.2818 -0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3801 0.2906 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7653 -0.2349 -0.8705 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2522 0.1616 0.3751 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9592 0.2573 0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9049 -1.9032 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0523 -1.1336 0.3026 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7906 1.6473 -0.5587 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3572 0.1360 2.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0482 -0.8020 -2.0159 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6786 2.9931 0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6953 1.9636 0.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7864 -1.9055 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7591 0.6008 2.4253 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4443 -0.3336 -1.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3103 0.3705 0.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8529 0.8560 0.5004 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9778 -2.9862 0.0727 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0180 -1.6174 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 17 2 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 19 1 0 0 0 0 14 26 1 0 0 0 0 15 20 2 0 0 0 0 15 27 1 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 21 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END $$$$