LIR5W6 -OEChem-05022321263D 28 29 0 0 0 0 0 0 0999 V2000 3.8353 0.0025 1.8564 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.1551 0.8062 -0.6666 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5108 3.0192 -0.5306 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3988 0.3796 2.2241 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7011 -2.8544 0.3554 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3771 -1.6202 -0.3425 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1872 -1.7448 0.0324 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2494 0.4063 0.5646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1696 0.2660 1.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 -0.7201 0.5104 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2572 0.0062 0.0807 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3613 -0.5887 0.0937 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7114 1.6569 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 0.6655 -0.2567 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0361 1.7883 -0.1905 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5654 -0.1172 0.5484 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -0.1204 -1.2823 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6055 -0.3671 -0.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0291 -0.3702 -2.1775 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3373 -0.4936 -1.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6149 -1.6815 0.7911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 2.5297 0.2784 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9867 -0.0320 -1.6902 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6239 -0.4631 0.0177 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8209 -0.4688 -3.2389 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1471 -0.6881 -2.4068 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 0.1006 -0.2958 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4429 2.9255 -0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 14 1 0 0 0 0 2 27 1 0 0 0 0 3 15 1 0 0 0 0 3 28 1 0 0 0 0 4 9 2 0 0 0 0 5 7 1 0 0 0 0 6 7 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 11 16 1 0 0 0 0 11 17 2 0 0 0 0 12 14 2 0 0 0 0 13 15 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 16 18 2 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 26 1 0 0 0 0 M CHG 2 5 -1 7 1 M END $$$$