B7LJ2S -OEChem-04042106133D 29 30 0 0 0 0 0 0 0999 V2000 -4.6070 2.8596 -0.0543 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -0.9814 -0.7336 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5243 1.3324 -0.2321 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.1045 -0.1962 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3402 0.2313 -0.4815 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4171 -1.0566 0.2299 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3074 -1.0013 -0.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 0.1278 -0.1574 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4411 0.1718 -0.4838 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6591 -2.2281 0.2913 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2997 -2.1985 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6518 1.1262 0.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8332 -1.0322 0.5575 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5225 0.1103 0.4865 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8732 1.3662 0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0491 0.7784 0.4012 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1917 0.4985 0.6409 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2174 -0.6504 -1.0528 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8472 -0.8105 0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9394 0.7582 0.3941 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2695 0.8785 -1.3633 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0151 1.1175 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -3.1702 0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2827 -3.1147 0.0174 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2267 1.6645 0.9625 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6203 1.8125 -0.7472 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3188 -1.9536 0.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5793 0.1247 0.7319 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2052 0.2500 0.8534 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 3 8 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 24 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 16 17 3 0 0 0 0 17 29 1 0 0 0 0 M END $$$$