B8JO5E -OEChem-04012114202D 68 72 0 0 0 0 0 0 0999 V2000 10.6746 3.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6354 1.6138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9426 2.9125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2105 0.9125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -3.2899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 -0.5875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2105 -2.0875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 -2.4239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8086 -3.5875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9426 3.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8086 2.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 2.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8086 4.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6746 2.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 1.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2105 -0.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4785 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3445 -1.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3445 -0.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5649 -1.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3739 -3.0820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 -1.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4059 -0.3936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1001 -0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 0.5846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -4.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8922 0.9447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9426 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9412 1.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8086 -1.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9426 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -4.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6746 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6746 -3.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4275 2.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7305 4.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3320 3.8049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4101 1.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2071 1.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8645 2.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4660 2.3049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2071 4.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4101 4.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8867 2.3299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2852 3.0202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2886 0.8299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6871 1.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6736 1.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8076 -0.2775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8347 -3.4969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9452 -0.8084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6898 -0.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9458 -4.8220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5906 -4.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8123 1.8602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4386 1.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6573 1.0852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0554 0.3039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8086 -0.9675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4056 -3.3975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2115 -1.7775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2115 -3.3975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0339 2.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2986 3.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 2.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 29 1 0 0 0 0 2 38 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 4 51 1 0 0 0 0 5 8 1 0 0 0 0 5 23 1 0 0 0 0 5 28 1 0 0 0 0 6 17 2 0 0 0 0 6 24 1 0 0 0 0 7 19 1 0 0 0 0 7 24 2 0 0 0 0 8 21 2 0 0 0 0 9 34 1 0 0 0 0 9 37 2 0 0 0 0 10 35 3 0 0 0 0 11 14 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 15 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 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 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 22 26 2 0 0 0 0 23 53 1 0 0 0 0 24 30 1 0 0 0 0 25 27 2 0 0 0 0 25 54 1 0 0 0 0 26 29 1 0 0 0 0 26 55 1 0 0 0 0 27 31 1 0 0 0 0 27 32 1 0 0 0 0 28 35 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 31 2 0 0 0 0 30 33 1 0 0 0 0 30 34 2 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 36 2 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 M END $$$$