D0KE3S -OEChem-04152108382D 79 81 0 1 0 0 0 0 0999 V2000 6.8671 -2.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8671 -2.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8671 -0.7785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4548 -1.7016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1458 -4.2707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2149 -3.5984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1285 -1.8295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 1.8195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8671 2.6856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8671 0.9535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8671 -0.7785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -4.5106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.0106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3671 5.2836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 -1.6446 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3671 -1.6446 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 -0.7785 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8671 -0.7785 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3671 0.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3671 0.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.0106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8671 -2.5106 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0010 -4.0106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4548 -3.3196 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 -4.5106 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 -4.0106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 -3.0106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4059 -3.0106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4059 -2.0106 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3671 1.8195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2149 -1.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8671 2.6856 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3671 3.5516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8671 4.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7471 -1.6446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9871 -1.6446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5571 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1771 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0571 0.6244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4747 0.6981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7844 0.2995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5856 -3.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -3.7006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4871 0.9535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8933 -3.7580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -4.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5571 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5571 -1.3155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.6306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3089 -3.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3089 -1.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1771 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -2.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -2.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -5.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -4.2006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5616 -0.9088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7689 -0.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5607 -4.7314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1771 3.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -5.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1501 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8921 3.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8921 3.1531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.6306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6301 -1.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1771 3.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3420 4.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3420 4.8162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6771 5.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7471 5.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18 1 1 6 0 0 0 24 1 1 6 0 0 0 19 2 1 1 0 0 0 25 2 1 6 0 0 0 21 3 1 6 0 0 0 3 58 1 0 0 0 0 4 24 1 0 0 0 0 4 30 1 0 0 0 0 5 25 1 0 0 0 0 5 32 1 0 0 0 0 27 6 1 1 0 0 0 6 65 1 0 0 0 0 28 7 1 1 0 0 0 7 67 1 0 0 0 0 29 8 1 6 0 0 0 8 68 1 0 0 0 0 31 9 1 1 0 0 0 9 69 1 0 0 0 0 10 35 1 0 0 0 0 10 74 1 0 0 0 0 11 33 2 0 0 0 0 36 12 1 6 0 0 0 12 75 1 0 0 0 0 22 13 1 1 0 0 0 13 33 1 0 0 0 0 13 49 1 0 0 0 0 20 14 1 1 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 26 15 1 6 0 0 0 15 61 1 0 0 0 0 15 62 1 0 0 0 0 16 34 1 0 0 0 0 16 72 1 0 0 0 0 16 73 1 0 0 0 0 17 38 1 0 0 0 0 17 78 1 0 0 0 0 17 79 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 1 0 0 0 0 19 40 1 0 0 0 0 20 23 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 28 1 0 0 0 0 26 48 1 0 0 0 0 27 31 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 34 1 1 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 35 1 6 0 0 0 32 57 1 0 0 0 0 33 36 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 M END $$$$