RDKit 3D 121126 0 0 0 0 0 0 0 0999 V2000 7.4223 4.1564 -0.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4825 3.0372 0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 2.9024 1.4481 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0833 2.1954 -0.6542 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2888 1.1056 -0.8118 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5615 -0.1065 0.0666 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6739 -1.2684 -0.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2978 -2.4504 -0.9098 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7301 -2.7194 -0.6591 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9326 -3.5933 0.4923 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5355 -1.4342 -0.7569 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3011 -1.0296 -2.2419 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9787 -1.6808 -0.6703 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0640 -0.7347 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2534 0.3762 0.1542 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9309 1.7250 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3837 2.3238 1.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9405 1.4060 1.9422 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8897 0.2443 1.3813 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0213 -0.3830 0.1659 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5880 -0.4914 1.5157 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6722 -0.7999 2.6672 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4461 -0.0385 2.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9419 0.2735 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6097 0.9761 1.4421 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6274 0.2235 0.7505 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3279 0.6184 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.6970 1.1395 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3576 -0.2215 -0.1053 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.4353 -0.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2986 1.2852 -0.9261 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8483 0.0904 0.9895 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1298 0.6415 1.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0389 0.1557 0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5719 -0.7016 -0.8019 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -1.2089 -1.8783 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8659 -1.4437 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3029 -0.6378 -0.2626 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.4766 0.5765 -0.0439 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7722 1.3267 1.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6583 0.5905 2.3984 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8785 1.0530 3.6704 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7401 0.2164 4.8901 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2199 2.2760 3.7746 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6059 1.5723 -1.1553 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8663 1.4462 -1.9292 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0542 0.8245 -1.2623 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.9252 1.9446 -0.6697 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8345 -0.3237 -0.3646 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.4301 -0.1350 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5055 -1.5860 -0.8431 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9419 -1.7039 -1.0199 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7040 -0.8897 -1.9499 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8212 -1.0789 -3.3156 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6258 -0.0914 -3.8075 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9893 0.6721 -2.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4630 0.2285 -1.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8814 3.9447 -1.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8415 5.1007 -0.2444 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1956 4.3008 0.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1963 0.7787 -1.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2262 1.4838 -0.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9092 -0.8736 -1.0494 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0315 -1.6066 0.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9937 -2.5571 -2.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7594 -3.3762 -0.4879 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0834 -3.2984 -1.5812 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8648 -3.5023 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9657 -4.6607 0.1078 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0329 -3.6621 1.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6796 -0.0283 -2.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9069 -1.7969 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2872 -1.2049 -2.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2551 -2.2744 0.2859 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2210 -2.5414 -1.4361 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0373 -1.3547 -0.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 -0.3602 -1.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4206 2.1406 -0.8242 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2909 3.3860 1.4193 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2825 -0.6668 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4889 0.5762 -0.2787 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0492 0.5097 1.8496 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4155 -1.2104 1.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4887 -1.9018 2.7213 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2233 -0.5410 3.6063 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9604 0.2644 3.5111 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6327 2.0249 1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2065 1.0029 2.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6813 -0.4248 -1.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2354 -1.2263 0.3982 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4454 0.3995 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9677 1.7397 1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5316 -1.0724 -0.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 -0.6171 -2.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0188 -2.2131 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4363 -1.2755 -2.3801 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9835 -2.5443 -1.2539 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2396 -1.2582 0.6434 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 2.0604 1.2848 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 2.0741 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3255 0.7769 5.7426 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 -0.1062 5.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0813 -0.6397 4.6865 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7544 1.5374 -1.8885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5414 2.6343 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2033 2.4952 -2.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6946 0.9714 -2.9173 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6809 0.4845 -2.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5611 1.6102 0.1445 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2350 2.7199 -0.3046 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5049 2.4418 -1.4902 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9177 -0.8582 1.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5174 -0.3739 0.9451 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3613 0.8141 1.4832 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2716 -2.3660 -0.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0489 -1.9684 -1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0901 -2.7774 -1.4218 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5129 -1.8299 -0.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3646 -1.8573 -3.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9145 0.0381 -4.8564 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5981 0.6723 -0.6894 H 0 0 0 0 0 0 0 0 0 0 0 0 10 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 6 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 30 31 2 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 1 0 38 49 1 0 49 50 1 1 49 51 1 0 51 52 1 0 52 53 1 0 53 57 2 0 57 56 1 0 56 55 1 0 55 54 2 0 49 47 1 0 47 48 1 0 47 46 1 0 46 45 1 0 45 39 1 0 39 40 1 1 40 41 1 0 41 42 1 0 42 43 1 0 42 44 2 0 20 11 1 0 11 12 1 6 11 13 1 0 13 14 1 0 14 15 1 0 15 19 2 0 19 18 1 0 18 17 1 0 17 16 2 0 11 9 1 0 16 15 1 0 24 6 1 0 39 34 1 0 39 38 1 0 54 53 1 0 10 68 1 0 10 69 1 0 10 70 1 0 9 67 1 6 8 65 1 0 8 66 1 0 7 63 1 0 7 64 1 0 5 61 1 0 5 62 1 0 1 58 1 0 1 59 1 0 1 60 1 0 20 81 1 6 21 82 1 0 21 83 1 0 22 84 1 0 22 85 1 0 23 86 1 0 25 87 1 0 25 88 1 0 29 89 1 0 29 90 1 0 33 91 1 0 33 92 1 0 35 93 1 0 36 94 1 0 36 95 1 0 37 96 1 0 37 97 1 0 38 98 1 1 50112 1 0 50113 1 0 50114 1 0 51115 1 0 51116 1 0 52117 1 0 52118 1 0 57121 1 0 55120 1 0 54119 1 0 47108 1 6 48109 1 0 48110 1 0 48111 1 0 46106 1 0 46107 1 0 45104 1 0 45105 1 0 40 99 1 0 40100 1 0 43101 1 0 43102 1 0 43103 1 0 12 71 1 0 12 72 1 0 12 73 1 0 13 74 1 0 13 75 1 0 14 76 1 0 14 77 1 0 19 80 1 0 17 79 1 0 16 78 1 0 M END