B5OF3I -OEChem-04022100202D 44 44 0 1 0 0 0 0 0999 V2000 3.7690 0.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.2220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 3.8201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 2.0880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 0.3560 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.0101 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4030 -2.0101 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 -2.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 1.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 1.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 2.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7690 2.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2690 2.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2690 2.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -1.1177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -0.4275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -0.4275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -1.1177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.6301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -2.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 0.3560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -2.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 -0.1810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3766 1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6864 1.4340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1613 0.6114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8516 1.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8766 2.6986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1864 2.3001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6613 1.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3516 1.8760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3766 3.5646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6864 3.1661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3890 3.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 29 1 0 0 0 0 12 2 1 1 0 0 0 2 30 1 0 0 0 0 13 3 1 6 0 0 0 3 31 1 0 0 0 0 4 14 1 0 0 0 0 4 33 1 0 0 0 0 5 15 2 0 0 0 0 6 21 1 0 0 0 0 6 44 1 0 0 0 0 7 21 2 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 M END $$$$