D0V0LU -OEChem-10101305022D 47 52 0 1 0 0 0 0 0999 V2000 7.7850 -0.4806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3944 -1.9430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2781 2.5404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5398 -0.4829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1212 3.0577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 -0.4738 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9930 -1.5153 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8750 0.0262 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1430 0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1158 -1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 -2.0430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2835 -0.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 1.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2701 -1.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7931 -1.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2722 1.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4011 0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8743 -3.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 1.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 2.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3954 1.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 -2.0502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7931 2.5747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8097 -3.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 3.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7493 -3.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4151 3.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7452 -0.8988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9735 -2.3651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6079 0.4569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7033 -2.4409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 -2.4663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3338 -3.4317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3184 1.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 1.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2743 -1.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 2.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8073 -4.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8886 3.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -3.4431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 3.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7283 3.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 3.3587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1019 2.5104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 17 1 0 0 0 0 2 16 2 0 0 0 0 3 18 1 0 0 0 0 3 29 1 0 0 0 0 4 19 1 0 0 0 0 4 43 1 0 0 0 0 5 22 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 30 1 6 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 31 1 6 0 0 0 8 12 1 0 0 0 0 8 32 1 1 0 0 0 9 13 1 0 0 0 0 9 14 2 0 0 0 0 10 16 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 17 1 0 0 0 0 11 20 2 0 0 0 0 12 15 2 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 18 2 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 15 22 1 0 0 0 0 17 24 2 0 0 0 0 18 23 1 0 0 0 0 19 23 2 0 0 0 0 20 26 1 0 0 0 0 20 35 1 0 0 0 0 21 25 2 0 0 0 0 21 36 1 0 0 0 0 22 27 2 0 0 0 0 23 37 1 0 0 0 0 24 28 1 0 0 0 0 24 38 1 0 0 0 0 25 27 1 0 0 0 0 25 39 1 0 0 0 0 26 28 2 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M END $$$$