LD0B3A -OEChem-05022322182D 42 44 0 0 0 0 0 0 0999 V2000 6.1056 -4.8933 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.8988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.6012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9146 -3.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5837 -4.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0837 -5.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -2.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0435 -2.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.2788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2003 -4.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3359 -5.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 5.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 5.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 23 1 0 0 0 0 2 15 2 0 0 0 0 3 24 2 0 0 0 0 4 7 1 0 0 0 0 4 15 1 0 0 0 0 4 28 1 0 0 0 0 5 10 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 16 1 0 0 0 0 6 24 1 0 0 0 0 6 38 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 26 1 0 0 0 0 10 14 1 0 0 0 0 11 14 2 0 0 0 0 11 27 1 0 0 0 0 12 21 2 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 29 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$