B7IUT8 -OEChem-04012120292D 99101 0 1 0 0 0 0 0999 V2000 8.5991 2.1900 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0991 1.3240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5127 -2.4033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6818 -4.0124 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.1900 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 0.6900 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 1.6900 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.3100 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4030 2.1900 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4651 0.6900 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0991 3.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 3.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 3.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9651 2.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7036 -3.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1818 -3.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 -0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 -1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -2.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -2.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -2.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -2.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -3.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -4.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -4.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -3.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -4.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -4.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0757 1.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6772 2.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 -2.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 -2.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9326 -0.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7297 -0.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0135 3.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 3.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 3.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9091 4.4590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 4.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5431 4.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 3.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9231 3.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6551 2.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5021 2.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2751 3.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6416 -1.7968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2429 -4.2194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7984 -3.0816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 23 2 1 6 0 0 0 2 67 1 0 0 0 0 24 3 1 1 0 0 0 3 72 1 0 0 0 0 25 4 1 1 0 0 0 4 80 1 0 0 0 0 5 26 2 0 0 0 0 28 6 1 6 0 0 0 6 90 1 0 0 0 0 9 35 1 0 0 0 0 9 91 1 0 0 0 0 10 33 2 0 0 0 0 19 11 1 1 0 0 0 11 26 1 0 0 0 0 11 64 1 0 0 0 0 12 27 1 0 0 0 0 12 33 1 0 0 0 0 12 75 1 0 0 0 0 13 39 1 0 0 0 0 13 44 1 0 0 0 0 13 92 1 0 0 0 0 14 41 1 0 0 0 0 14 44 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 48 1 0 0 0 0 16 19 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 20 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 21 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 23 1 0 0 0 0 19 55 1 0 0 0 0 20 22 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 25 28 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 27 32 1 0 0 0 0 27 66 1 0 0 0 0 28 35 1 0 0 0 0 28 68 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 29 69 1 0 0 0 0 30 36 1 0 0 0 0 30 37 1 0 0 0 0 30 38 1 0 0 0 0 31 70 1 0 0 0 0 31 71 1 0 0 0 0 32 39 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 34 40 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 35 78 1 0 0 0 0 35 79 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 37 84 1 0 0 0 0 37 85 1 0 0 0 0 37 86 1 0 0 0 0 38 87 1 0 0 0 0 38 88 1 0 0 0 0 38 89 1 0 0 0 0 39 41 2 0 0 0 0 40 42 2 0 0 0 0 40 43 1 0 0 0 0 41 93 1 0 0 0 0 42 45 1 0 0 0 0 42 94 1 0 0 0 0 43 46 2 0 0 0 0 43 95 1 0 0 0 0 44 96 1 0 0 0 0 45 47 2 0 0 0 0 45 97 1 0 0 0 0 46 47 1 0 0 0 0 46 98 1 0 0 0 0 47 99 1 0 0 0 0 M END $$$$