B3Q2WS -OEChem-04022103173D 29 30 0 0 0 0 0 0 0999 V2000 0.6494 1.1332 1.0085 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5935 -1.3400 -0.4812 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -2.4163 0.7961 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2019 0.0461 0.1252 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7098 -1.5891 -1.2612 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0157 1.4057 0.6272 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6192 1.9447 0.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.0434 0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9539 -1.0926 0.8172 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6513 -0.2845 -1.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -0.1153 0.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0787 2.1098 -0.3166 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6005 -0.2074 -0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2759 -2.0989 -0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0991 0.8591 -0.7527 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3383 2.0176 -0.9086 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3938 -1.4155 0.1577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2082 1.3689 1.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7809 2.0362 0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5425 2.9698 0.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4705 1.9483 -0.7403 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5841 -1.1031 1.8331 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9193 0.4484 -1.8597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9387 -0.9389 1.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5317 3.0398 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -3.1644 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0748 0.8305 -1.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7293 2.8507 -1.4857 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1209 -2.1590 -0.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 17 1 0 0 0 0 2 29 1 0 0 0 0 3 17 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 10 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 9 14 2 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 11 13 2 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 13 15 1 0 0 0 0 13 17 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 M END $$$$