D0M3MN -OEChem-10101305032D 57 59 0 1 0 0 0 0 0999 V2000 13.8116 0.1981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 3.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8232 3.2674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.7292 1.7119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.2327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5933 3.2568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.7327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1972 2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 2.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8232 1.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7292 2.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.2673 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.8827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9851 3.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5866 2.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9326 0.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7297 0.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 3.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8160 3.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 -0.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -0.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -1.8499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -1.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -1.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1315 2.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5910 3.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 2 0 0 0 0 2 21 2 0 0 0 0 3 31 2 0 0 0 0 4 33 1 0 0 0 0 4 56 1 0 0 0 0 5 33 2 0 0 0 0 6 34 1 0 0 0 0 6 57 1 0 0 0 0 7 34 2 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 21 1 0 0 0 0 9 16 1 0 0 0 0 9 19 1 0 0 0 0 9 40 1 0 0 0 0 10 17 1 0 0 0 0 10 22 1 0 0 0 0 10 41 1 0 0 0 0 11 19 1 0 0 0 0 11 23 1 0 0 0 0 11 42 1 0 0 0 0 12 20 1 0 0 0 0 12 23 2 0 0 0 0 26 13 1 6 0 0 0 13 31 1 0 0 0 0 13 51 1 0 0 0 0 14 23 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 43 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 24 29 1 0 0 0 0 24 45 1 0 0 0 0 25 30 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 33 1 0 0 0 0 26 44 1 0 0 0 0 27 32 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 32 34 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$