L98PDQ -OEChem-05022323402D 39 41 0 0 0 0 0 0 0999 V2000 7.4604 0.1971 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1949 -3.1797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8270 0.3211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.1797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.0817 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7337 -1.4584 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1514 -0.7540 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2119 -0.8003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 0.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 1.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 0.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7392 -1.5630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1514 -0.7540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3164 -1.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4028 -2.2016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 2.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2337 -0.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6514 0.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3222 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 2.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1819 -1.8348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9101 -2.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.7017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5080 -2.3845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9228 -1.6660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6717 1.9018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 2.7678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6685 2.6306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6514 1.4049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6726 -0.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1306 0.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7326 0.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5138 -0.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 2.7783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 1.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 20 1 0 0 0 0 2 17 2 0 0 0 0 3 19 2 0 0 0 0 4 22 2 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 26 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 7 14 1 0 0 0 0 7 15 2 0 0 0 0 8 16 1 0 0 0 0 8 19 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 20 2 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 20 32 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$