D0V1EK -OEChem-10101305032D 28 29 0 0 0 0 0 0 0999 V2000 3.8366 1.2820 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 2.5080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 -0.1192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8147 1.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 0.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2215 2.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6337 3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.0975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2444 -0.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9258 0.4546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3741 1.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1353 3.5769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2693 3.7141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1321 2.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.8325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 10 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 7 2 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 13 16 2 0 0 0 0 13 23 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 M END $$$$