1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90
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OpenBabel09140922232D
40 45 0 0 0 0 0 0 0 0999 V2000
-11.1500 -2.3000 0.0000 C 0 0 0 0 0
-11.1484 -3.3000 0.0000 C 0 0 0 0 0
-12.0173 -1.8023 0.0000 C 0 0 0 0 0
-10.2842 -1.7995 0.0000 C 0 0 0 0 0
-10.2816 -3.7986 0.0000 C 0 0 0 0 0
-10.2800 -4.7986 0.0000 C 0 0 0 0 0
-11.1452 -5.3000 0.0000 C 0 0 0 0 0
-12.0120 -4.8014 0.0000 C 0 0 0 0 0
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-12.8820 -2.3046 0.0000 C 0 0 0 0 0
-13.7494 -1.8069 0.0000 C 0 0 0 0 0
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-12.8874 -0.3046 0.0000 C 0 0 0 0 0
-12.0200 -0.8023 0.0000 C 0 0 0 0 0
-10.2848 -0.7995 0.0000 C 0 0 0 0 0
-9.4190 -0.2991 0.0000 C 0 0 0 0 0
-8.5527 -0.7986 0.0000 C 0 0 0 0 0
-8.5522 -1.7986 0.0000 C 0 0 0 0 0
-9.4179 -2.2991 0.0000 C 0 0 0 0 0
-11.1436 -6.3000 0.0000 C 0 0 0 0 0
-7.6870 -0.2982 0.0000 C 0 0 0 0 0
-14.6194 -0.3092 0.0000 C 0 0 0 0 0
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-7.6875 0.7018 0.0000 C 0 0 0 0 0
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34 35 1 0 0 0
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36 37 1 0 0 0
M END
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