D01IRO -OEChem-04152111163D 33 35 0 0 0 0 0 0 0999 V2000 -5.9610 -0.4594 -0.0827 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8638 -1.6162 -0.1206 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4878 -1.7631 -0.3133 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3903 0.7579 0.0241 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3583 -0.4298 0.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8033 0.6866 0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8117 -0.4357 0.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -0.5702 0.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -1.6700 0.1267 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2323 2.0148 -0.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6665 -1.7401 0.1631 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5521 1.8743 0.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5272 3.1847 -0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5397 -0.3870 1.2102 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4782 -0.4919 -1.2027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9167 3.1146 -0.0414 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8774 -0.7243 0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9339 -0.3946 1.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8726 -0.4996 -1.2379 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6004 -0.4509 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2957 -2.5945 0.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3133 2.1248 -0.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1323 -2.7203 0.2254 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6375 1.8829 0.0377 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0356 -0.3427 2.1727 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9258 -0.5302 -2.1387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0337 4.1507 -0.1324 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5069 4.0260 -0.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4722 0.0804 0.6376 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4955 -0.3566 2.1046 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -0.5438 -2.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2529 -0.5012 -1.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2049 -2.4361 -0.5161 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 3 17 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 2 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 14 2 0 0 0 0 7 15 1 0 0 0 0 8 11 2 0 0 0 0 8 17 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 10 13 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 12 16 1 0 0 0 0 12 24 1 0 0 0 0 13 16 2 0 0 0 0 13 27 1 0 0 0 0 14 18 1 0 0 0 0 14 25 1 0 0 0 0 15 19 2 0 0 0 0 15 26 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 M END $$$$