RDKit 3D 84 87 0 0 0 0 0 0 0 0999 V2000 1.1867 -2.0989 -2.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -1.8587 -1.3225 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9461 -2.0122 -0.9327 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6624 -2.5591 -1.9702 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3771 -0.5899 -0.7324 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1952 0.3597 -0.8996 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7915 0.3826 -2.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0214 1.3782 -3.1081 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 1.2393 -4.5292 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6555 2.4287 -2.8571 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9831 0.0230 0.0059 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6077 0.2174 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6544 -0.6526 1.6716 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3692 -0.6505 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4746 -1.6065 3.0887 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9843 0.1970 3.7312 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5783 -1.3622 -0.1724 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5836 -2.1692 -0.1860 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4173 -3.0002 1.0476 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1755 -4.3142 1.0953 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0221 -5.0459 2.3754 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0798 -4.9423 0.0258 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0156 -1.8818 -0.0335 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8134 -1.6913 -1.2859 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7477 -0.4993 -1.2349 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7677 -0.4506 -1.8671 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4506 0.7241 -0.3742 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7043 2.0069 -1.0542 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3021 0.5112 0.7039 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9619 -0.8149 0.9547 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4164 -0.7929 0.8859 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0080 -0.9168 2.2895 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 0.4157 0.0846 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4810 0.1252 -1.2028 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1494 1.3246 0.6830 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5224 2.6722 0.3823 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6111 3.6777 1.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9969 5.0220 0.7793 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3734 3.4276 2.5028 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1777 1.2057 -0.1069 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8871 2.3454 0.3676 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9573 3.5413 -0.3151 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7507 4.6525 0.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3616 3.6604 -1.4247 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1177 -1.8722 -2.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1469 -2.3238 -3.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0314 -2.6731 -0.0633 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1417 -3.3746 -2.2824 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0251 -0.3532 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0217 -0.2754 -1.6564 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6185 1.3446 -0.6448 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0169 1.9003 -5.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3924 1.4756 -4.4395 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6728 0.2010 -4.8835 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8427 0.0511 2.2027 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 1.2924 1.5583 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4373 -1.1911 2.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2609 -2.5826 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5778 -1.8197 4.1603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2389 -1.8929 0.6847 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4135 -3.0506 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0735 -5.0603 2.6736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4781 -6.0298 2.3841 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -4.4537 3.2146 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -2.7926 0.4731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5867 -2.5434 -1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -1.7345 -2.2413 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6114 1.9081 -1.7036 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9849 2.7716 -0.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8707 2.4312 -1.6195 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4265 -1.5439 0.3246 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3421 -1.0167 1.9795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1383 0.0394 2.8399 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0185 -1.2929 2.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -1.6080 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8401 0.6749 -1.9115 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9762 1.2768 1.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9696 5.3748 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8891 5.0252 -0.3289 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2295 5.7910 1.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1327 1.4427 -1.1407 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7621 5.5294 -0.4042 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7802 4.3189 0.4284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2863 5.0074 1.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 15 14 1 0 14 16 2 0 14 13 1 0 13 12 1 0 11 12 1 1 11 6 1 0 6 5 1 0 5 3 1 0 3 4 1 0 3 2 1 0 2 1 2 3 2 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 2 0 18 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 6 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 1 31 33 1 0 33 34 1 6 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 2 0 35 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 2 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 2 0 17 11 1 0 31 23 1 0 40 11 1 0 33 27 1 0 15 57 1 0 15 58 1 0 15 59 1 0 12 55 1 0 12 56 1 0 6 51 1 1 5 49 1 0 5 50 1 0 3 47 1 1 4 48 1 0 1 45 1 0 1 46 1 0 17 60 1 1 18 61 1 6 21 62 1 0 21 63 1 0 21 64 1 0 23 65 1 1 24 66 1 0 24 67 1 0 28 68 1 0 28 69 1 0 28 70 1 0 30 71 1 0 30 72 1 0 32 73 1 0 32 74 1 0 32 75 1 0 34 76 1 0 35 77 1 1 38 78 1 0 38 79 1 0 38 80 1 0 40 81 1 6 43 82 1 0 43 83 1 0 43 84 1 0 9 52 1 0 9 53 1 0 9 54 1 0 M END