D0M6IJ -OEChem-10101305022D 41 45 0 0 0 0 0 0 0999 V2000 4.6660 -3.2673 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -1.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -3.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -3.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -1.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 2.7742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1741 1.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2801 3.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1821 2.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -0.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -3.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -0.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -1.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -3.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -3.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8415 3.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7074 1.4234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2777 3.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7203 3.0891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 8 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 4 7 1 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 13 2 0 0 0 0 6 17 2 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 9 11 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 23 2 0 0 0 0 11 27 1 0 0 0 0 12 20 1 0 0 0 0 12 28 1 0 0 0 0 13 19 1 0 0 0 0 13 29 1 0 0 0 0 14 18 1 0 0 0 0 14 24 2 0 0 0 0 15 18 2 0 0 0 0 15 30 1 0 0 0 0 16 22 1 0 0 0 0 16 31 1 0 0 0 0 17 21 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 37 1 0 0 0 0 22 36 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M END $$$$